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11 Commits
Author SHA1 Message Date
Peter Boyle b039e659af 4D pseudo fermion 2026-08-12 12:51:55 -04:00
Peter Boyle d16d44dda0 Prepare for reduced Ls during evolution forces using 4D pseudo fermion.
Worth an effort to understand if the different stochastic estimator is cleaner.
2026-08-12 12:51:01 -04:00
Peter Boyle 1c19389ba6 Two flavour boson term 2026-08-12 12:50:32 -04:00
Peter Boyle 02fdff674c Test the PVdagM left prec pseudofermion formulation 2026-08-12 12:49:59 -04:00
Peter Boyle fd8b6a23a6 PvDagM or other left prec precon two flavour ratio 2026-08-12 12:49:21 -04:00
Peter Boyle 9e3a51d078 Use the new DenseCoarseInverse class 2026-08-12 12:48:19 -04:00
Peter Boyle 6f7a2ad7c7 Dense coarse inverse wrapper class, bundling up a bunch of useful work 2026-08-12 12:47:40 -04:00
Peter Boyle 499d656949 Batch blas test 2026-08-12 12:47:16 -04:00
Peter Boyle ba68f09026 Batch inverse 2026-08-12 12:46:56 -04:00
Peter Boyle 3bdeeb73ef Update 2026-08-12 12:44:56 -04:00
Peter Boyle 19868a800f Blas optimise change 2026-08-12 12:43:40 -04:00
11 changed files with 3380 additions and 5 deletions

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+32 -5
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@@ -31,12 +31,18 @@ Key configure options:
| `--with-gmp=`, `--with-mpfr=`, `--with-fftw=`, `--with-lime=` | paths to libs |
| `--enable-hdf5`, `--enable-mkl`, `--enable-lapack` | optional features |
GPU builds additionally need `--enable-gen-simd-width=64` (sets 512-bit SIMD width for GPU warp/wavefront sizing) and `--enable-unified=no --enable-shm=nvlink` for multi-GPU runs.
To speed up compilation, `--disable-fermion-reps --disable-gparity` skips instantiating G-parity and higher-representation fermion operators.
Platform recipes from `README.md`:
- **KNL**: `--enable-simd=KNL --enable-comms=mpi3-auto --enable-mkl`
- **Skylake/Haswell**: `--enable-simd=AVX512` or `AVX2` + `--enable-comms=mpi3-auto`
- **AMD EPYC**: `--enable-simd=AVX2 --enable-comms=mpi3`
- **A64FX (Fugaku)**: `--enable-simd=A64FX --enable-comms=mpi3 --enable-shm=shmget` (see `SVE_README.txt`)
Complete, working `configure` invocations for specific HPC systems (Frontier/ROCm, Perlmutter/CUDA, Summit, SDCC-A100, etc.) live in `systems/<platform>/config-command`. These are the canonical references for production builds.
Required external libs: GMP, MPFR, OpenSSL, zlib.
### Use `systems/` for real machines
@@ -59,9 +65,9 @@ Note the GPU builds use `--enable-simd=GPU --enable-gen-simd-width=64`, so `Nsim
```bash
# From build directory
make check # runs only Test_simd, Test_cshift, Test_stencil, Test_dwf_mixedcg_prec
make -C tests/<subdir> tests # build (not run) the tests in a subdirectory
make bench # build benchmarks
make check # root-level tests (Test_simd, Test_cshift, etc.)
make -C tests/<subdir> tests # build tests in a subdirectory
make tests # build all tests across all subdirectories
./tests/core/Test_simd # run a single test binary directly
mpirun -n 4 ./tests/core/Test_cshift --grid 16.16.16.16 --mpi 1.1.1.4
```
@@ -84,7 +90,7 @@ Tests and benchmarks that need optional fermion representations are guarded by `
4. **Cartesian/comms layer** (`Grid/cartesian/`, `Grid/communicator/`) — `GridCartesian` holds the MPI topology and local/global geometry. `Grid/cshift/` implements nearest-neighbour halo exchange; `Grid/stencil/` is the optimised multi-hop stencil used by Dirac operators.
5. **Algorithm layer** (`Grid/algorithms/`) — iterative solvers (CG, GMRES, BiCGSTAB, mixed-precision), eigensolvers (Lanczos, LAPACK), FFT, smearing.
5. **Algorithm layer** (`Grid/algorithms/`) — iterative solvers (CG, GMRES, BiCGSTAB, mixed-precision), eigensolvers (Lanczos, LAPACK), FFT, smearing, and multigrid.
6. **QCD layer** (`Grid/qcd/`) — gauge and fermion actions, HMC integrators, observables.
@@ -98,6 +104,11 @@ Tests and benchmarks that need optional fermion representations are guarded by `
- `observables/` — Polyakov loop, plaquette, topological charge
### GPU acceleration and the view/memory-manager discipline
### Multigrid (`Grid/algorithms/multigrid/`)
Aggregation-based algebraic multigrid for Wilson-type fermions. Key files: `CoarsenedMatrix.h` (coarse operator), `GeneralCoarsenedMatrix.h` and `GeneralCoarsenedMatrixMultiRHS.h` (general coarsening supporting multi-RHS solves), `Aggregates.h` (near-null vector construction), `Geometry.h` (coarse-grid geometry). `MultiGrid.h` is the top-level include.
### GPU acceleration
GPU support is injected via macros in `Grid/threads/Accelerator.h` — `accelerator_for(i, n, nsimd, {...})`, `accelerator_forNB` (non-blocking, must be followed by `accelerator_barrier()`), `accelerator_for2dNB`, and `accelerator_inline`. On a CPU build these degrade to `thread_for` (OpenMP). Unified virtual memory is on by default (`--enable-unified=yes`); device-aware MPI (`--enable-accelerator-aware-mpi`) avoids device→host copies on transfers.
@@ -127,6 +138,20 @@ Modes are `AcceleratorRead/Write/WriteDiscard` and `CpuRead/Write/WriteDiscard`.
| `correctness-verification.md` | Double-run fingerprinting, per-packet checksums, flight recorder |
| `hang-diagnosis.md` | Diagnosing MPI/accelerator hangs |
The key loop macros (defined in `Grid/threads/Accelerator.h`) are:
- `accelerator_for(iter, num, nsimd, {...})` — maps to CUDA/HIP kernel or OpenMP loop; `nsimd` is the innermost SIMD lane count
- `accelerator_forNB(...)` — non-blocking variant (no implicit barrier)
- `accelerator_for2dNB(iter1, num1, iter2, num2, nsimd, {...})` — 2D kernel launch
- `thread_for(iter, num, {...})` — CPU OpenMP loop (never dispatches to GPU)
On CPU builds, `accelerator_for` aliases to `thread_for`.
### Solver patterns
`SchurRedBlack` (`Grid/algorithms/iterative/SchurRedBlack.h`) implements red-black (even/odd) preconditioning for fermion operators. Most production fermion solves use `SchurRedBlackDiagMooeeSolve` or similar wrappers that internally call a `ConjugateGradient` on the Schur complement.
Mixed-precision solvers (`ConjugateGradientMixedPrec`, `BiCGSTABMixedPrec`) drive a double-precision outer loop with single-precision inner solves.
### Memory and I/O
- `Grid/allocator/` — aligned/NUMA-aware allocators; caching allocator via `--enable-alloc-cache`
@@ -146,7 +171,9 @@ Every programme is wrapped in `Grid_init(&argc, &argv)` / `Grid_finalize()` (`Gr
## Key Conventions
- **C++17** is required throughout.
- Template structure: most classes are templated on `<_FImpl>` (fermion impl) or `<Gimpl>` (gauge impl), which encode the representation and precision. Instantiation is controlled by `--enable-fermion-instantiations`; the explicit instantiation `.cc` files live under `Grid/qcd/action/fermion/instantiation/<Impl>/` and are selected by `scripts/filelist`.
- Template structure: most classes are templated on `<_FImpl>` (fermion impl) or `<Gimpl>` (gauge impl), which encode the representation and precision. Instantiation is controlled by `--enable-fermion-instantiations`.
- **Tensor indices are positional, not labelled.** The `Grid/tensors/` arithmetic recurses structurally over the `iScalar`/`iVector`/`iMatrix` nest: each level defines only the {scalar,vector,matrix}² products at its own level, with element types resolved by automatic type deduction, so every colour/spin/lorentz combination composes from ~200 lines (versus the pre-C++11 QDP++/PETE approach of machine-generating every case). An index's meaning derives entirely from its nesting depth counted from the outside; `iScalar` is the identity/broadcast case at every level. Never insert or remove a nesting level casually — the multiplication tables contract by position.
- **Multigrid coarsening deepens the tensor nest by one level.** A coarse site vector is `iVector<CComplex,nbasis>`, and `innerProduct` on it returns `iScalar<CComplex>` — one level deeper than the fine block scalar. So the block-inner-product scalar type gains one `iScalar` wrapper per MG level (fine: `vTComplex`; level 2: `iScalar<vTComplex>`; see `examples/Example_pvdagm_3level.cc`). When calling `blockInnerProduct`/`blockZAXPY`/`blockOrthogonalise` on coarse fields, the coarse scalar type must match `decltype(innerProduct(siteVector(),siteVector()))` exactly; a wrong depth fails to compile (no viable `operator=` deep in the instantiation chain) rather than mis-contracting.
- The `RealD`/`RealF`/`ComplexD`/`ComplexF` typedefs are used everywhere; avoid raw `double`/`float`.
- Use `GRID_ASSERT(cond)` (defined in `Grid/GridStd.h`), not bare `assert` — it prints a Grid-formatted message and aborts cleanly under MPI.
- Logging is stream-based, not macro-based: `std::cout << GridLogMessage << ... << std::endl;`. Channels declared in `Grid/log/Log.h` include `GridLogError`, `GridLogWarning`, `GridLogDebug`, `GridLogPerformance`, `GridLogIterative`, `GridLogSolver`, `GridLogHMC`, `GridLogComms`, `GridLogMemory`, `GridLogDslash`, `GridLogIRL`, `GridLogMG`. A subset is switched on at runtime with e.g. `--log Error,Warning,Message,Performance,Iterative,Integrator,Debug,Colours` (names given without the `GridLog` prefix).
+222
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@@ -695,6 +695,228 @@ public:
RealD bytes = 1.0*sizeof(ComplexF)*(m*k+k*n+m*n)*batchCount;
}
///////////////////////////////////////////////////////////////////////////////////
// Explicit-leading-dimension complex single GEMM.
//
// A,B,C may be SLICES of larger parent allocations: lda/ldb/ldc are the
// PARENT strides (>= the compact values the ten-argument overload derives).
// Motivating use: software split-K for tiny-output/huge-K dense multiplies
// (arXiv:2409.03904 fig 11; cf MultiRHSBlockCGLinalg) -- batch over K-chunks
// of a dense slab by pointer offset j*Kchunk with lda = the full K extent,
// then reduce the partial C's. Backends pass lda straight through; only
// the compact overload invented them.
///////////////////////////////////////////////////////////////////////////////////
void gemmBatched(GridBLASOperation_t OpA,
GridBLASOperation_t OpB,
int m,int n, int k,
ComplexF alpha,
deviceVector<ComplexF*> &Amk, int lda,
deviceVector<ComplexF*> &Bkn, int ldb,
ComplexF beta,
deviceVector<ComplexF*> &Cmn, int ldc,
GridBLASPrecision_t precision = GridBLAS_PRECISION_DEFAULT)
{
RealD t2=usecond();
int32_t batchCount = Amk.size();
GRID_ASSERT( lda >= ((OpA==GridBLAS_OP_N) ? m : k) );
GRID_ASSERT( ldb >= ((OpB==GridBLAS_OP_N) ? k : n) );
GRID_ASSERT( ldc >= m );
static deviceVector<ComplexF> alpha_p(1);
static deviceVector<ComplexF> beta_p(1);
acceleratorCopyToDevice((void *)&alpha,(void *)&alpha_p[0],sizeof(ComplexF));
acceleratorCopyToDevice((void *)&beta ,(void *)&beta_p[0],sizeof(ComplexF));
RealD t0=usecond();
GRID_ASSERT(Bkn.size()==batchCount);
GRID_ASSERT(Cmn.size()==batchCount);
#ifdef GRID_HIP
GRID_ASSERT(precision == GridBLAS_PRECISION_DEFAULT);
hipblasOperation_t hOpA;
hipblasOperation_t hOpB;
if ( OpA == GridBLAS_OP_N ) hOpA = HIPBLAS_OP_N;
if ( OpA == GridBLAS_OP_T ) hOpA = HIPBLAS_OP_T;
if ( OpA == GridBLAS_OP_C ) hOpA = HIPBLAS_OP_C;
if ( OpB == GridBLAS_OP_N ) hOpB = HIPBLAS_OP_N;
if ( OpB == GridBLAS_OP_T ) hOpB = HIPBLAS_OP_T;
if ( OpB == GridBLAS_OP_C ) hOpB = HIPBLAS_OP_C;
#if defined(HIP_VERSION_MAJOR) && (HIP_VERSION_MAJOR >=7)
auto err = hipblasCgemmBatched(gridblasHandle,
hOpA,
hOpB,
m,n,k,
(hipComplex *) &alpha_p[0],
(hipComplex **)&Amk[0], lda,
(hipComplex **)&Bkn[0], ldb,
(hipComplex *) &beta_p[0],
(hipComplex **)&Cmn[0], ldc,
batchCount);
#else
auto err = hipblasCgemmBatched(gridblasHandle,
hOpA,
hOpB,
m,n,k,
(hipblasComplex *) &alpha_p[0],
(hipblasComplex **)&Amk[0], lda,
(hipblasComplex **)&Bkn[0], ldb,
(hipblasComplex *) &beta_p[0],
(hipblasComplex **)&Cmn[0], ldc,
batchCount);
#endif
GRID_ASSERT(err==HIPBLAS_STATUS_SUCCESS);
#endif
#ifdef GRID_CUDA
cublasOperation_t hOpA;
cublasOperation_t hOpB;
if ( OpA == GridBLAS_OP_N ) hOpA = CUBLAS_OP_N;
if ( OpA == GridBLAS_OP_T ) hOpA = CUBLAS_OP_T;
if ( OpA == GridBLAS_OP_C ) hOpA = CUBLAS_OP_C;
if ( OpB == GridBLAS_OP_N ) hOpB = CUBLAS_OP_N;
if ( OpB == GridBLAS_OP_T ) hOpB = CUBLAS_OP_T;
if ( OpB == GridBLAS_OP_C ) hOpB = CUBLAS_OP_C;
cublasStatus_t err;
if (precision == GridBLAS_PRECISION_DEFAULT) {
err = cublasCgemmBatched(gridblasHandle,
hOpA,
hOpB,
m,n,k,
(cuComplex *) &alpha_p[0],
(cuComplex **)&Amk[0], lda,
(cuComplex **)&Bkn[0], ldb,
(cuComplex *) &beta_p[0],
(cuComplex **)&Cmn[0], ldc,
batchCount);
} else {
cublasComputeType_t compute_precision = toDataType(precision);
err = cublasGemmBatchedEx(gridblasHandle,
hOpA,
hOpB,
m,n,k,
(void *) &alpha_p[0],
(void **)&Amk[0], CUDA_C_32F, lda,
(void **)&Bkn[0], CUDA_C_32F, ldb,
(void *) &beta_p[0],
(void **)&Cmn[0], CUDA_C_32F, ldc,
batchCount, compute_precision, CUBLAS_GEMM_DEFAULT);
}
GRID_ASSERT(err==CUBLAS_STATUS_SUCCESS);
#endif
#ifdef GRID_SYCL
GRID_ASSERT(precision == GridBLAS_PRECISION_DEFAULT);
int64_t m64=m;
int64_t n64=n;
int64_t k64=k;
int64_t lda64=lda;
int64_t ldb64=ldb;
int64_t ldc64=ldc;
int64_t batchCount64=batchCount;
oneapi::mkl::transpose iOpA;
oneapi::mkl::transpose iOpB;
if ( OpA == GridBLAS_OP_N ) iOpA = oneapi::mkl::transpose::N;
if ( OpA == GridBLAS_OP_T ) iOpA = oneapi::mkl::transpose::T;
if ( OpA == GridBLAS_OP_C ) iOpA = oneapi::mkl::transpose::C;
if ( OpB == GridBLAS_OP_N ) iOpB = oneapi::mkl::transpose::N;
if ( OpB == GridBLAS_OP_T ) iOpB = oneapi::mkl::transpose::T;
if ( OpB == GridBLAS_OP_C ) iOpB = oneapi::mkl::transpose::C;
oneapi::mkl::blas::column_major::gemm_batch(*gridblasHandle,
&iOpA,
&iOpB,
&m64,&n64,&k64,
(ComplexF *) &alpha_p[0],
(const ComplexF **)&Amk[0], (const int64_t *)&lda64,
(const ComplexF **)&Bkn[0], (const int64_t *)&ldb64,
(ComplexF *) &beta_p[0],
(ComplexF **)&Cmn[0], (const int64_t *)&ldc64,
(int64_t)1,&batchCount64,std::vector<sycl::event>());
synchronise();
#endif
#if !defined(GRID_SYCL) && !defined(GRID_CUDA) && !defined(GRID_HIP)
GRID_ASSERT(precision == GridBLAS_PRECISION_DEFAULT);
// Reference implementation: Eigen with explicit outer stride
typedef Eigen::Map<Eigen::MatrixXcf,0,Eigen::OuterStride<> > eMat;
if ( (OpA == GridBLAS_OP_N ) && (OpB == GridBLAS_OP_N) ) {
thread_for (p, batchCount, {
eMat eAmk(Amk[p],m,k,Eigen::OuterStride<>(lda));
eMat eBkn(Bkn[p],k,n,Eigen::OuterStride<>(ldb));
eMat eCmn(Cmn[p],m,n,Eigen::OuterStride<>(ldc));
if (std::abs(beta) != 0.0)
eCmn = beta * eCmn + alpha * eAmk * eBkn ;
else
eCmn = alpha * eAmk * eBkn ;
});
} else if ( (OpA == GridBLAS_OP_C ) && (OpB == GridBLAS_OP_N) ) {
thread_for (p, batchCount, {
eMat eAmk(Amk[p],k,m,Eigen::OuterStride<>(lda));
eMat eBkn(Bkn[p],k,n,Eigen::OuterStride<>(ldb));
eMat eCmn(Cmn[p],m,n,Eigen::OuterStride<>(ldc));
if (std::abs(beta) != 0.0)
eCmn = beta * eCmn + alpha * eAmk.adjoint() * eBkn ;
else
eCmn = alpha * eAmk.adjoint() * eBkn ;
});
} else if ( (OpA == GridBLAS_OP_T ) && (OpB == GridBLAS_OP_N) ) {
thread_for (p, batchCount, {
eMat eAmk(Amk[p],k,m,Eigen::OuterStride<>(lda));
eMat eBkn(Bkn[p],k,n,Eigen::OuterStride<>(ldb));
eMat eCmn(Cmn[p],m,n,Eigen::OuterStride<>(ldc));
if (std::abs(beta) != 0.0)
eCmn = beta * eCmn + alpha * eAmk.transpose() * eBkn ;
else
eCmn = alpha * eAmk.transpose() * eBkn ;
});
} else if ( (OpA == GridBLAS_OP_N ) && (OpB == GridBLAS_OP_C) ) {
thread_for (p, batchCount, {
eMat eAmk(Amk[p],m,k,Eigen::OuterStride<>(lda));
eMat eBkn(Bkn[p],n,k,Eigen::OuterStride<>(ldb));
eMat eCmn(Cmn[p],m,n,Eigen::OuterStride<>(ldc));
if (std::abs(beta) != 0.0)
eCmn = beta * eCmn + alpha * eAmk * eBkn.adjoint() ;
else
eCmn = alpha * eAmk * eBkn.adjoint() ;
});
} else if ( (OpA == GridBLAS_OP_N ) && (OpB == GridBLAS_OP_T) ) {
thread_for (p, batchCount, {
eMat eAmk(Amk[p],m,k,Eigen::OuterStride<>(lda));
eMat eBkn(Bkn[p],n,k,Eigen::OuterStride<>(ldb));
eMat eCmn(Cmn[p],m,n,Eigen::OuterStride<>(ldc));
if (std::abs(beta) != 0.0)
eCmn = beta * eCmn + alpha * eAmk * eBkn.transpose() ;
else
eCmn = alpha * eAmk * eBkn.transpose() ;
});
} else if ( (OpA == GridBLAS_OP_C ) && (OpB == GridBLAS_OP_C) ) {
thread_for (p, batchCount, {
eMat eAmk(Amk[p],k,m,Eigen::OuterStride<>(lda));
eMat eBkn(Bkn[p],n,k,Eigen::OuterStride<>(ldb));
eMat eCmn(Cmn[p],m,n,Eigen::OuterStride<>(ldc));
if (std::abs(beta) != 0.0)
eCmn = beta * eCmn + alpha * eAmk.adjoint() * eBkn.adjoint() ;
else
eCmn = alpha * eAmk.adjoint() * eBkn.adjoint() ;
} );
} else if ( (OpA == GridBLAS_OP_T ) && (OpB == GridBLAS_OP_T) ) {
thread_for (p, batchCount, {
eMat eAmk(Amk[p],k,m,Eigen::OuterStride<>(lda));
eMat eBkn(Bkn[p],n,k,Eigen::OuterStride<>(ldb));
eMat eCmn(Cmn[p],m,n,Eigen::OuterStride<>(ldc));
if (std::abs(beta) != 0.0)
eCmn = beta * eCmn + alpha * eAmk.transpose() * eBkn.transpose() ;
else
eCmn = alpha * eAmk.transpose() * eBkn.transpose() ;
} );
} else {
assert(0);
}
#endif
RealD t1=usecond();
RealD flops = 8.0*m*n*k*batchCount;
RealD bytes = 1.0*sizeof(ComplexF)*(m*k+k*n+m*n)*batchCount;
}
///////////////////////////////////////////////////////////////////////////
// Single precision real GEMM
///////////////////////////////////////////////////////////////////////////
+282
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@@ -0,0 +1,282 @@
/*************************************************************************************
Grid physics library, www.github.com/paboyle/Grid
Source file: BatchedInverse.h
Copyright (C) 2026
Author: Peter Boyle <pboyle@bnl.gov>
This program is free software; you can redistribute it and/or modify
it under the terms of the GNU General Public License as published by
the Free Software Foundation; either version 2 of the License, or
(at your option) any later version.
This program is distributed in the hope that it will be useful,
but WITHOUT ANY WARRANTY; without even the implied warranty of
MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
GNU General Public License for more details.
You should have received a copy of the GNU General Public License along
with this program; if not, write to the Free Software Foundation, Inc.,
51 Franklin Street, Fifth Floor, Boston, MA 02110-1301 USA.
See the full license in the file "LICENSE" in the top level distribution directory
*************************************************************************************/
/* END LEGAL */
#pragma once
#include <Grid/algorithms/blas/BatchedBlas.h>
#ifdef GRID_HIP
#include <rocsolver/rocsolver.h>
#endif
// GRID_CUDA: batched LU inversion lives in cuBLAS (getrfBatched/getriBatched);
// cublas_v2.h already included via BatchedBlas.h.
// GRID_SYCL: oneapi/mkl.hpp already included via BatchedBlas.h (lapack::getrf/getri).
NAMESPACE_BEGIN(Grid);
///////////////////////////////////////////////////////////////////////////////
// GridBLASInverse: cross-platform batched dense matrix inversion.
//
// HIGH LEVEL contract (deliberately NOT a getrf/getrs interface): invert a
// batch of dense N x N matrices IN PLACE,
//
// A[i] <- A[i]^{-1} i = 0 .. batchCount-1
//
// Layout: column major, lda = N, contiguous per batch element; pointer list
// exactly as GridBLAS::gemmBatched (deviceVector<T*> of device pointers).
// Each backend chooses HOW:
// HIP : rocSOLVER getrf_batched + getri_batched
// CUDA : cuBLAS getrfBatched + getriBatched (out-of-place getri; workspace
// hidden here, result copied back so the surface stays in-place)
// SYCL : oneMKL LAPACK getrf + getri per batch element (USM, in-order queue)
// CPU : Eigen PartialPivLU (the correctness oracle for all of the above)
//
// The int32 vendor-batched entry points bound N < 2^31 (asserted); the huge
// single-matrix ILP64 path (getrf_64 + blocked identity-getrs harvest, proven
// in the dense coarse-coarse setup at N=69120) migrates here as a batch==1
// large-N dispatch in a follow-up -- the recursive Schur leaves are the
// batched consumers this surface is shaped for.
//
// NB GPU-backend call signatures are written to vendor documentation but the
// air-gapped development loop compiles only the CPU/Eigen path; verify the
// rocSOLVER/cuBLAS/oneMKL calls against headers on first device compile.
// Semantics are locked by the CPU unit test (Test_batched_blas).
///////////////////////////////////////////////////////////////////////////////
class GridBLASInverse {
public:
#ifdef GRID_HIP
// rocSOLVER runs on a rocblas_handle (distinct type from hipblasHandle_t)
static rocblas_handle & Handle(void) {
static rocblas_handle h;
static int init = 0;
if ( !init ) {
auto st = rocblas_create_handle(&h);
GRID_ASSERT(st == rocblas_status_success);
init = 1;
}
return h;
}
#endif
#ifdef GRID_CUDA
// cuBLAS batched LU shares the GridBLAS handle
static cublasHandle_t & Handle(void) {
GridBLAS::Init();
return GridBLAS::gridblasHandle;
}
#endif
#ifdef GRID_SYCL
static sycl::queue * & Handle(void) {
GridBLAS::Init();
return GridBLAS::gridblasHandle;
}
#endif
GridBLASInverse() {};
~GridBLASInverse() {};
void inverseBatched(int64_t N, deviceVector<ComplexF*> &Amat)
{
int32_t batchCount = Amat.size();
GRID_ASSERT(batchCount > 0);
#ifdef GRID_HIP
GRID_ASSERT( N < 2147483647L );
rocblas_int n = (rocblas_int)N;
rocblas_int lda = (rocblas_int)N;
deviceVector<rocblas_int> ipiv((uint64_t)batchCount*N);
deviceVector<rocblas_int> info(batchCount);
auto st1 = rocsolver_cgetrf_batched(Handle(), n, n,
(rocblas_float_complex *const *)&Amat[0], lda,
&ipiv[0], (rocblas_stride)N,
&info[0], batchCount);
GRID_ASSERT(st1 == rocblas_status_success);
auto st2 = rocsolver_cgetri_batched(Handle(), n,
(rocblas_float_complex *const *)&Amat[0], lda,
&ipiv[0], (rocblas_stride)N,
&info[0], batchCount);
GRID_ASSERT(st2 == rocblas_status_success);
accelerator_barrier();
std::vector<rocblas_int> info_h(batchCount);
acceleratorCopyFromDevice(&info[0],&info_h[0],batchCount*sizeof(rocblas_int));
for(int i=0;i<batchCount;i++) GRID_ASSERT(info_h[i]==0); // singular pivot => abort loudly
#endif
#ifdef GRID_CUDA
GRID_ASSERT( N < 2147483647L );
int n = (int)N;
deviceVector<int> ipiv((uint64_t)batchCount*N);
deviceVector<int> info(batchCount);
auto st1 = cublasCgetrfBatched(Handle(), n,
(cuComplex **)&Amat[0], n,
&ipiv[0], &info[0], batchCount);
GRID_ASSERT(st1 == CUBLAS_STATUS_SUCCESS);
// getri is OUT of place: hidden workspace keeps the surface in-place
deviceVector<ComplexF> work((uint64_t)batchCount*N*N);
deviceVector<ComplexF*> Cptr(batchCount);
std::vector<ComplexF*> Cptr_h(batchCount);
std::vector<ComplexF*> Aptr_h(batchCount);
for(int i=0;i<batchCount;i++) Cptr_h[i] = &work[(uint64_t)i*N*N];
acceleratorCopyToDevice(&Cptr_h[0],&Cptr[0],batchCount*sizeof(ComplexF*));
acceleratorCopyFromDevice(&Amat[0],&Aptr_h[0],batchCount*sizeof(ComplexF*));
auto st2 = cublasCgetriBatched(Handle(), n,
(const cuComplex *const *)&Amat[0], n,
&ipiv[0],
(cuComplex **)&Cptr[0], n,
&info[0], batchCount);
GRID_ASSERT(st2 == CUBLAS_STATUS_SUCCESS);
accelerator_barrier();
std::vector<int> info_h(batchCount);
acceleratorCopyFromDevice(&info[0],&info_h[0],batchCount*sizeof(int));
for(int i=0;i<batchCount;i++) GRID_ASSERT(info_h[i]==0);
for(int i=0;i<batchCount;i++)
acceleratorCopyDeviceToDevice(Cptr_h[i],Aptr_h[i],(uint64_t)N*N*sizeof(ComplexF));
#endif
#ifdef GRID_SYCL
// Per-element oneMKL LAPACK on the in-order queue; group API optimisation later.
sycl::queue *q = Handle();
std::vector<ComplexF*> Aptr_h(batchCount);
acceleratorCopyFromDevice(&Amat[0],&Aptr_h[0],batchCount*sizeof(ComplexF*));
int64_t lwf = oneapi::mkl::lapack::getrf_scratchpad_size<std::complex<float> >(*q,N,N,N);
int64_t lwi = oneapi::mkl::lapack::getri_scratchpad_size<std::complex<float> >(*q,N,N);
deviceVector<ComplexF> scratchf(lwf);
deviceVector<ComplexF> scratchi(lwi);
deviceVector<int64_t> ipiv(N);
for(int i=0;i<batchCount;i++){
oneapi::mkl::lapack::getrf(*q,N,N,(std::complex<float>*)Aptr_h[i],N,&ipiv[0],
(std::complex<float>*)&scratchf[0],lwf);
oneapi::mkl::lapack::getri(*q,N, (std::complex<float>*)Aptr_h[i],N,&ipiv[0],
(std::complex<float>*)&scratchi[0],lwi);
}
q->wait();
#endif
#if !defined(GRID_SYCL) && !defined(GRID_CUDA) && !defined(GRID_HIP)
// Reference implementation; the oracle the unit test locks semantics with.
thread_for (p, batchCount, {
Eigen::Map<Eigen::MatrixXcf> eA(Amat[p],N,N);
Eigen::PartialPivLU<Eigen::MatrixXcf> lu(eA);
eA = lu.inverse();
});
#endif
}
void inverseBatched(int64_t N, deviceVector<ComplexD*> &Amat)
{
int32_t batchCount = Amat.size();
GRID_ASSERT(batchCount > 0);
#ifdef GRID_HIP
GRID_ASSERT( N < 2147483647L );
rocblas_int n = (rocblas_int)N;
rocblas_int lda = (rocblas_int)N;
deviceVector<rocblas_int> ipiv((uint64_t)batchCount*N);
deviceVector<rocblas_int> info(batchCount);
auto st1 = rocsolver_zgetrf_batched(Handle(), n, n,
(rocblas_double_complex *const *)&Amat[0], lda,
&ipiv[0], (rocblas_stride)N,
&info[0], batchCount);
GRID_ASSERT(st1 == rocblas_status_success);
auto st2 = rocsolver_zgetri_batched(Handle(), n,
(rocblas_double_complex *const *)&Amat[0], lda,
&ipiv[0], (rocblas_stride)N,
&info[0], batchCount);
GRID_ASSERT(st2 == rocblas_status_success);
accelerator_barrier();
std::vector<rocblas_int> info_h(batchCount);
acceleratorCopyFromDevice(&info[0],&info_h[0],batchCount*sizeof(rocblas_int));
for(int i=0;i<batchCount;i++) GRID_ASSERT(info_h[i]==0);
#endif
#ifdef GRID_CUDA
GRID_ASSERT( N < 2147483647L );
int n = (int)N;
deviceVector<int> ipiv((uint64_t)batchCount*N);
deviceVector<int> info(batchCount);
auto st1 = cublasZgetrfBatched(Handle(), n,
(cuDoubleComplex **)&Amat[0], n,
&ipiv[0], &info[0], batchCount);
GRID_ASSERT(st1 == CUBLAS_STATUS_SUCCESS);
deviceVector<ComplexD> work((uint64_t)batchCount*N*N);
deviceVector<ComplexD*> Cptr(batchCount);
std::vector<ComplexD*> Cptr_h(batchCount);
std::vector<ComplexD*> Aptr_h(batchCount);
for(int i=0;i<batchCount;i++) Cptr_h[i] = &work[(uint64_t)i*N*N];
acceleratorCopyToDevice(&Cptr_h[0],&Cptr[0],batchCount*sizeof(ComplexD*));
acceleratorCopyFromDevice(&Amat[0],&Aptr_h[0],batchCount*sizeof(ComplexD*));
auto st2 = cublasZgetriBatched(Handle(), n,
(const cuDoubleComplex *const *)&Amat[0], n,
&ipiv[0],
(cuDoubleComplex **)&Cptr[0], n,
&info[0], batchCount);
GRID_ASSERT(st2 == CUBLAS_STATUS_SUCCESS);
accelerator_barrier();
std::vector<int> info_h(batchCount);
acceleratorCopyFromDevice(&info[0],&info_h[0],batchCount*sizeof(int));
for(int i=0;i<batchCount;i++) GRID_ASSERT(info_h[i]==0);
for(int i=0;i<batchCount;i++)
acceleratorCopyDeviceToDevice(Cptr_h[i],Aptr_h[i],(uint64_t)N*N*sizeof(ComplexD));
#endif
#ifdef GRID_SYCL
sycl::queue *q = Handle();
std::vector<ComplexD*> Aptr_h(batchCount);
acceleratorCopyFromDevice(&Amat[0],&Aptr_h[0],batchCount*sizeof(ComplexD*));
int64_t lwf = oneapi::mkl::lapack::getrf_scratchpad_size<std::complex<double> >(*q,N,N,N);
int64_t lwi = oneapi::mkl::lapack::getri_scratchpad_size<std::complex<double> >(*q,N,N);
deviceVector<ComplexD> scratchf(lwf);
deviceVector<ComplexD> scratchi(lwi);
deviceVector<int64_t> ipiv(N);
for(int i=0;i<batchCount;i++){
oneapi::mkl::lapack::getrf(*q,N,N,(std::complex<double>*)Aptr_h[i],N,&ipiv[0],
(std::complex<double>*)&scratchf[0],lwf);
oneapi::mkl::lapack::getri(*q,N, (std::complex<double>*)Aptr_h[i],N,&ipiv[0],
(std::complex<double>*)&scratchi[0],lwi);
}
q->wait();
#endif
#if !defined(GRID_SYCL) && !defined(GRID_CUDA) && !defined(GRID_HIP)
thread_for (p, batchCount, {
Eigen::Map<Eigen::MatrixXcd> eA(Amat[p],N,N);
Eigen::PartialPivLU<Eigen::MatrixXcd> lu(eA);
eA = lu.inverse();
});
#endif
}
};
NAMESPACE_END(Grid);
@@ -0,0 +1,702 @@
/*************************************************************************************
Grid physics library, www.github.com/paboyle/Grid
Source file: ./lib/algorithms/multigrid/DenseCoarseMatrix.h
Copyright (C) 2026
Author: Peter Boyle <pboyle@bnl.gov>
This program is free software; you can redistribute it and/or modify
it under the terms of the GNU General Public License as published by
the Free Software Foundation; either version 2 of the License, or
(at your option) any later version.
This program is distributed in the hope that it will be useful,
but WITHOUT ANY WARRANTY; without even the implied warranty of
MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
GNU General Public License for more details.
You should have received a copy of the GNU General Public License along
with this program; if not, write to the Free Software Foundation, Inc.,
51 Franklin Street, Fifth Floor, Boston, MA 02110-1301 USA.
See the full license in the file "LICENSE" in the top level distribution directory
*************************************************************************************/
/* END LEGAL */
#pragma once
#include <Grid/algorithms/blas/BatchedBlas.h>
#include <Grid/algorithms/blas/BatchedInverse.h>
#include <unordered_map>
NAMESPACE_BEGIN(Grid);
//////////////////////////////////////////////////////////////////////////////////////
// DenseCoarseMatrix: a coarsened operator treated as a DENSE matrix -- explicit,
// row-distributed A^{-1} of a GeneralCoarsenedMatrix. Library-grade successor of
// the example-local DistributedDenseInverse (Example_pvdagm_mrhs_3level_dense.cc,
// FROZEN as the regression baseline).
//
// What is new versus the example class:
// - Stencil -> dense DIRECT IMPORT. The coarse operator IS the dense matrix
// unrolled: Dense[(s,a),(s+shift_p,b)] += A[p][s]_{a,b}. Rows of my sites are
// assembled from purely LOCAL _A[p] data: no operator applies, no comms -- the
// O(N) probe assembly (93 s at N=69120) is retired. ACCUMULATE (+=) because on
// short axes distinct shifts wrap to the same neighbour. An IMPORT CERTIFICATE
// compares the dense apply against Op.M on a NON-CONSTANT vector (a constant one
// cannot see a shift-sign error); DENSE_IMPORT_SIGN=-1 flips the convention
// without recompiling.
// - Split-K apply through GridBLAS.gemmBatched with EXPLICIT leading dimensions
// (arXiv:2409.03904 fig 11): the tiny-output/huge-K GEMM Y = slab^T X becomes
// DENSE_SPLITK chunk-GEMMs by pointer offset into the resident slab (lda = N),
// partials reduced in one accelerator_for. Platform-agnostic: deviceVector +
// GridBLAS run the SAME code on HIP/CUDA/SYCL and CPU(Eigen).
// - deviceVector everywhere in the apply path; the ONE surviving naked-HIP block
// is the boss inversion buffer (quarantined below, documented).
//
// Setup: SLAB_FILE=<stem> loads per-rank <stem>.<rank> (header-guarded N/nrows/
// nbasis -- the interchange format shared with the frozen example; the STEM must
// encode cfg/mass/blocking/nbasis, only the header is guarded). Absent: direct
// import -> import certificate -> chunked zero-fill+GlobalSum gather streamed to
// the boss GCD -> cgetrf_64 (ILP64) -> rows of A^{-1} via blocked identity
// cgetrs_64 + broadcast, each rank keeping the rows of its own sites -> save.
// VERIFY ||A Ainv x - x||/||x|| runs in BOTH paths (and now certifies the DEVICE
// slab + split-K path, since the single-RHS apply routes through the same core).
//
// Env: SLAB_FILE DENSE_SPLITK (default 32, snapped to a divisor of N)
// DENSE_DEVICE_SUM DENSE_IMPORT_SIGN DENSE_APPLY_PROFILE DENSE_CC_CHECK
//
// Eventual internal upgrade (unchanged surface): RecursiveSchur distributed
// factorisation replacing the single-GCD gather/invert, lifting BOTH the fp32
// N ~ 90k boss-HBM ceiling AND the CC-grid 256-rank SIMD cap; leaves land on
// GridBLASInverse::inverseBatched.
//
// Tensor-depth agnostic: site scalar objects treated as contiguous ComplexD
// (iScalar wrappers add no data), so any MG level's coarse operator imports.
//////////////////////////////////////////////////////////////////////////////////////
template<class Fobj,class CComplex,int nbasis>
class DenseCoarseMatrix : public LinearFunction<typename GeneralCoarsenedMatrix<Fobj,CComplex,nbasis>::CoarseVector> {
public:
typedef GeneralCoarsenedMatrix<Fobj,CComplex,nbasis> GeneralCoarseOp;
typedef typename GeneralCoarseOp::CoarseVector Field;
typedef typename GeneralCoarseOp::CoarseMatrix CoarseMatrix;
using LinearFunction<Field>::operator();
typedef typename Field::vector_object vobj;
typedef typename vobj::scalar_object sobj;
typedef typename CoarseMatrix::vector_object Mvobj;
typedef typename Mvobj::scalar_object Msobj;
GeneralCoarseOp &_Op; // the coarse operator: stencil source + certificate oracle
GridBase *grid;
int nd;
int64_t N; // dense rank = gSites * nbasis
int lsites; // my local sites
int64_t nrows; // my rows = lsites * nbasis
std::vector<Coordinate> myLcoor; // local coordinate of my site ss
std::vector<int64_t> myGsite; // global lex site index of my site ss
std::vector<ComplexF> slab; // nrows x N row-major: A during setup, rows of A^{-1} after
static const int64_t CHUNKROWS = 1024; // getrs harvest block (trsm efficiency + fewer broadcasts)
static const int MRHS_MAX = 32;
// Apply machinery: resident slab + persistent buffers + AOT split-K pointers.
GridBLAS BLAS;
deviceVector<ComplexF> dSlab;
deviceVector<ComplexF> dX; // N x MRHS_MAX
deviceVector<ComplexF> dY; // nrows x MRHS_MAX
deviceVector<ComplexF> dPartial; // NK x (nrows x MRHS_MAX)
deviceVector<ComplexF*> aptrs; // slab K-chunk pointers (lda = N)
deviceVector<ComplexF*> xptrs; // X K-chunk pointers (ldb = N)
deviceVector<ComplexF*> cptrs; // partial buffers (ldc = nrows)
std::vector<ComplexF> hX;
std::vector<ComplexF> hY;
int NK; // split-K chunk count (divides N)
int devSum;
DenseCoarseMatrix(GeneralCoarseOp &Op, GridBase *g)
: _Op(Op), grid(g)
{
GRID_ASSERT( sizeof(sobj) == nbasis*sizeof(ComplexD) );
GRID_ASSERT( sizeof(Msobj) == nbasis*nbasis*sizeof(ComplexD) );
GRID_ASSERT( grid == Op.Grid() );
nd = grid->_ndimension;
N = grid->gSites() * nbasis;
lsites = grid->lSites();
nrows = (int64_t)lsites * nbasis;
std::cout << GridLogMessage << "DenseCoarseMatrix: N = " << N
<< " (" << grid->gSites() << " sites x " << nbasis << ")"
<< " rows/rank = " << nrows
<< " slab = " << (double)nrows*N*sizeof(ComplexF)/1024./1024. << " MB/rank"
<< std::endl;
////////////////////////////////////////////////////////////////////
// Enumerate my sites: local coords and global lexicographic indices
////////////////////////////////////////////////////////////////////
Coordinate ldims = grid->LocalDimensions();
Coordinate gdims = grid->GlobalDimensions();
myLcoor.resize(lsites);
myGsite.resize(lsites);
for(int ss=0; ss<lsites; ss++){
Coordinate lcoor(nd);
Lexicographic::CoorFromIndex(lcoor, ss, ldims);
Coordinate gcoor(nd);
for(int d=0; d<nd; d++) gcoor[d] = grid->_lstart[d] + lcoor[d];
int64_t gsite;
Lexicographic::IndexFromCoor(gcoor, gsite, gdims);
myLcoor[ss] = lcoor;
myGsite[ss] = gsite;
}
slab.resize((uint64_t)nrows * N);
double t0 = usecond();
////////////////////////////////////////////////////////////////////
// 0. Slab cache: SLAB_FILE=<stem> -> per-rank raw file <stem>.<rank>.
// SAME format as the frozen example (interchange compatible).
////////////////////////////////////////////////////////////////////
bool loaded = false;
char *sfile = getenv("SLAB_FILE");
std::string slabfile;
if (sfile) {
slabfile = std::string(sfile) + "." + std::to_string(grid->ThisRank());
FILE *f = fopen(slabfile.c_str(),"rb");
if (f) {
int64_t hdr[4] = {0,0,0,0};
GRID_ASSERT( fread(hdr,sizeof(int64_t),4,f) == 4 );
GRID_ASSERT( hdr[0] == (int64_t)0x44454E5345 ); // magic "DENSE"
GRID_ASSERT( hdr[1] == N && hdr[2] == (int64_t)nrows && hdr[3] == (int64_t)nbasis );
uint64_t nelem = (uint64_t)nrows * N;
GRID_ASSERT( fread(&slab[0], sizeof(ComplexF), nelem, f) == nelem );
fclose(f);
loaded = true;
std::cout << GridLogMessage << "DenseCoarseMatrix: slab loaded from "
<< slabfile << " -- skipping import/factor/solve" << std::endl;
} else {
std::cout << GridLogMessage << "DenseCoarseMatrix: slab cache " << slabfile
<< " absent -- full setup, will write it" << std::endl;
}
}
if (!loaded) {
ImportDense(); // slab <- my rows of A (LOCAL, no comms)
ImportCertificate(); // dense apply == Op.M on a non-constant vector
InvertDense(); // slab <- my rows of A^{-1}
double t1 = usecond();
if (sfile) {
FILE *f = fopen(slabfile.c_str(),"wb");
GRID_ASSERT(f != nullptr);
int64_t hdr[4] = { (int64_t)0x44454E5345, N, (int64_t)nrows, (int64_t)nbasis };
GRID_ASSERT( fwrite(hdr,sizeof(int64_t),4,f) == 4 );
uint64_t nelem = (uint64_t)nrows * N;
GRID_ASSERT( fwrite(&slab[0], sizeof(ComplexF), nelem, f) == nelem );
fclose(f);
std::cout << GridLogMessage << "DenseCoarseMatrix: slab written to " << slabfile << std::endl;
}
std::cout << GridLogMessage << "DenseCoarseMatrix: import+invert took "
<< (t1-t0)/1.0e6 << " s" << std::endl;
}
////////////////////////////////////////////////////////////////////
// Device residency + persistent apply buffers + AOT split-K pointers
////////////////////////////////////////////////////////////////////
{
uint64_t sbytes = (uint64_t)nrows * N * sizeof(ComplexF);
dSlab.resize((uint64_t)nrows*N);
acceleratorCopyToDevice(&slab[0],&dSlab[0],sbytes);
// DENSE_SPLITK: requested chunk count, snapped DOWN to a divisor of N.
int req = getenv("DENSE_SPLITK") ? atoi(getenv("DENSE_SPLITK")) : 32;
if (req < 1) req = 1;
NK = 1;
for(int j=1;j<=req;j++) if ( (N % j) == 0 ) NK = j;
int64_t Kc = N / NK;
dX.resize((uint64_t)N*MRHS_MAX);
dY.resize((uint64_t)nrows*MRHS_MAX);
dPartial.resize((uint64_t)NK*nrows*MRHS_MAX);
hX.resize((uint64_t)N*MRHS_MAX);
hY.resize((uint64_t)nrows*MRHS_MAX);
aptrs.resize(NK); xptrs.resize(NK); cptrs.resize(NK);
std::vector<ComplexF*> h(NK);
for(int j=0;j<NK;j++) h[j] = &dSlab[0] + (uint64_t)j*Kc; // K-offset, lda=N
acceleratorCopyToDevice(&h[0],&aptrs[0],NK*sizeof(ComplexF*));
for(int j=0;j<NK;j++) h[j] = &dX[0] + (uint64_t)j*Kc; // K-offset, ldb=N
acceleratorCopyToDevice(&h[0],&xptrs[0],NK*sizeof(ComplexF*));
for(int j=0;j<NK;j++) h[j] = &dPartial[0] + (uint64_t)j*nrows*MRHS_MAX; // compact, ldc=nrows
acceleratorCopyToDevice(&h[0],&cptrs[0],NK*sizeof(ComplexF*));
devSum = getenv("DENSE_DEVICE_SUM") ? 1 : 0;
std::cout << GridLogMessage << "DenseCoarseMatrix: slab resident on device ("
<< sbytes/1024./1024. << " MB/rank), split-K NK=" << NK << " (Kc=" << Kc << "); "
<< (devSum ? "DEVICE-buffer allreduce (GPU-aware MPI)" : "host allreduce")
<< std::endl;
}
////////////////////////////////////////////////////////////////////
// VERIFY: || A (Ainv x) - x || / ||x|| through the DEVICE split-K core.
////////////////////////////////////////////////////////////////////
{
Field x(grid); Field y(grid); Field z(grid);
x = ComplexD(1.0,0.0);
double ta = usecond();
(*this)(x, y);
double tb = usecond();
_Op.M(y, z);
z = z - x;
RealD rel = std::sqrt(norm2(z)/norm2(x));
std::cout << GridLogMessage << "DenseCoarseMatrix: VERIFY ||A Ainv x - x||/||x|| = "
<< rel << " (one apply took " << (tb-ta)/1000.0 << " ms)" << std::endl;
GRID_ASSERT(rel < 1.0e-2);
}
std::cout << GridLogMessage << "DenseCoarseMatrix: setup complete, total "
<< (usecond()-t0)/1.0e6 << " s" << std::endl;
}
////////////////////////////////////////////////////////////////////
// 1. Direct stencil -> dense import of MY ROWS of A (no comms):
// Dense[(s,a),(wrap(s+shift_p),b)] += A[p][s]_{a,b}
////////////////////////////////////////////////////////////////////
void ImportDense(void)
{
double t = -usecond();
Coordinate gdims = grid->GlobalDimensions();
int sign = getenv("DENSE_IMPORT_SIGN") ? atoi(getenv("DENSE_IMPORT_SIGN")) : 1;
GRID_ASSERT( sign==1 || sign==-1 );
uint64_t nelem = (uint64_t)nrows * N;
thread_for(i, nelem, { slab[i] = ComplexF(0.0,0.0); });
for(int p=0; p<_Op.geom.npoint; p++){
Coordinate shift = _Op.geom.shifts[p];
autoView(Av, _Op._A[p], CpuRead);
thread_for(ss, lsites, {
Coordinate ncoor(nd);
for(int d=0; d<nd; d++){
int64_t g = grid->_lstart[d] + myLcoor[ss][d] + sign*shift[d];
ncoor[d] = (int)((g % gdims[d] + gdims[d]) % gdims[d]);
}
int64_t nsite;
Lexicographic::IndexFromCoor(ncoor, nsite, gdims);
Msobj m;
peekLocalSite(m, Av, myLcoor[ss]);
ComplexD *md = (ComplexD *)&m;
for(int a=0; a<nbasis; a++){
ComplexF *row = &slab[(uint64_t)(ss*nbasis+a)*N + nsite*nbasis];
for(int b=0; b<nbasis; b++)
row[b] += ComplexF(md[a*nbasis+b]); // += : wrapped shifts may collide
}
});
}
t += usecond();
std::cout << GridLogMessage << "DenseCoarseMatrix: stencil->dense import took "
<< t/1.0e6 << " s (" << _Op.geom.npoint << " points, local, no comms)" << std::endl;
}
////////////////////////////////////////////////////////////////////
// 2. IMPORT CERTIFICATE: dense rows vs Op.M on a NON-CONSTANT vector.
// (Constant x has x[s+d]==x[s-d]: blind to a shift-sign error.)
////////////////////////////////////////////////////////////////////
void ImportCertificate(void)
{
Field x(grid); Field Ax(grid); Field Dx(grid);
for(int ss=0; ss<lsites; ss++){
sobj s;
for(int b=0; b<nbasis; b++){
double ph = 0.37*(double)(myGsite[ss]*nbasis+b);
((ComplexD *)&s)[b] = ComplexD(std::cos(ph),std::sin(0.61*ph));
}
pokeLocalSite(s, x, myLcoor[ss]);
}
// gather full x (zero-fill + exact GlobalSum), dense rows on host
std::vector<ComplexD> xh((uint64_t)N, ComplexD(0.0,0.0));
for(int ss=0; ss<lsites; ss++){
sobj s;
peekLocalSite(s, x, myLcoor[ss]);
for(int b=0; b<nbasis; b++) xh[ myGsite[ss]*nbasis + b ] = ((ComplexD *)&s)[b];
}
grid->GlobalSumVector(&xh[0], (int)N);
std::vector<ComplexD> yh(nrows);
thread_for(r, nrows, {
ComplexD acc(0.0,0.0);
const ComplexF *row = &slab[(uint64_t)r * N];
for(int64_t j=0; j<N; j++) acc += ComplexD(row[j]) * xh[j];
yh[r] = acc;
});
for(int ss=0; ss<lsites; ss++){
sobj s;
for(int b=0; b<nbasis; b++) ((ComplexD *)&s)[b] = yh[ss*nbasis+b];
pokeLocalSite(s, Dx, myLcoor[ss]);
}
_Op.M(x, Ax);
Field d(grid); d = Dx - Ax;
RealD rel = std::sqrt(norm2(d)/norm2(Ax));
std::cout << GridLogMessage << "DenseCoarseMatrix: IMPORT CERTIFICATE ||Dense x - A x||/||A x|| = "
<< rel << std::endl;
if ( rel >= 1.0e-3 ) {
std::cout << GridLogMessage << "DenseCoarseMatrix: IMPORT CERTIFICATE FAILED. If O(1), the "
<< "stencil shift-sign convention is opposite: rerun with DENSE_IMPORT_SIGN=-1"
<< std::endl;
}
GRID_ASSERT(rel < 1.0e-3);
}
////////////////////////////////////////////////////////////////////
// 3. Invert: chunked zero-fill+GlobalSum gather of A streamed to the
// boss GCD, cgetrf_64 (ILP64), rows of A^{-1} by blocked identity
// cgetrs_64 + broadcast; each rank keeps its own rows (in `slab`,
// overwriting A). Ported proven path from the frozen example.
////////////////////////////////////////////////////////////////////
void InvertDense(void)
{
double t1 = usecond();
int boss = grid->IsBoss();
std::vector<ComplexF> Afull;
#ifdef GRID_HIP
// QUARANTINED naked HIP: the boss-only N^2 inversion buffer (34GB at
// N=65536) must come from raw HBM; EvictAll flushes the device-copy
// layer to make the window. (FreePool of the allocator free-list
// awaits the type-dispatched fix.) Confined to setup; the apply path
// is pure Grid primitives.
rocblas_float_complex *dA = nullptr;
rocblas_float_complex *dB = nullptr;
int64_t *dIpiv = nullptr;
uint64_t Abytes = (uint64_t)N * N * sizeof(ComplexF);
MemoryManager::EvictAll();
if (boss) {
auto aerr = hipMalloc((void **)&dA, Abytes);
if (aerr != hipSuccess) {
std::cout << GridLogMessage << "DenseCoarseMatrix: hipMalloc of "
<< Abytes/1024./1024./1024. << " GB FAILED -- reduce --device-mem" << std::endl;
GRID_ASSERT(aerr == hipSuccess);
}
std::cout << GridLogMessage << "DenseCoarseMatrix: device inversion buffer allocated ("
<< Abytes/1024./1024./1024. << " GB)" << std::endl;
}
#else
if (boss) Afull.resize((uint64_t)N * N);
#endif
{
std::unordered_map<int64_t,int> rowmap; // global row -> my slab row
for(int ss=0; ss<lsites; ss++)
for(int a=0; a<nbasis; a++)
rowmap[ myGsite[ss]*nbasis + a ] = ss*nbasis + a;
std::vector<ComplexF> chunk((uint64_t)CHUNKROWS * N);
for(int64_t row0=0; row0<N; row0+=CHUNKROWS){
int64_t nrow = std::min(CHUNKROWS, N-row0);
uint64_t nelem = (uint64_t)nrow * N;
for(uint64_t i=0;i<nelem;i++) chunk[i]=ComplexF(0.0,0.0);
for(int64_t r=row0; r<row0+nrow; r++){
auto it = rowmap.find(r);
if (it != rowmap.end()) {
uint64_t src = (uint64_t)(it->second) * N;
uint64_t dst = (uint64_t)(r-row0) * N;
for(int64_t j=0;j<N;j++) chunk[dst+j] = slab[src+j];
}
}
grid->GlobalSumVector(&chunk[0], (int)nelem);
if (boss) {
#ifdef GRID_HIP
GRID_ASSERT( hipMemcpy((char *)dA + (uint64_t)row0*N*sizeof(ComplexF),
&chunk[0], nelem*sizeof(ComplexF),
hipMemcpyHostToDevice) == hipSuccess );
#else
uint64_t dst = (uint64_t)row0 * N;
for(uint64_t i=0;i<nelem;i++) Afull[dst+i] = chunk[i];
#endif
}
}
}
double t2 = usecond();
std::cout << GridLogMessage << "DenseCoarseMatrix: gather to boss took "
<< (t2-t1)/1.0e6 << " s" << std::endl;
////////////////////////////////////////////////////////////////////
// Factor in place on the boss (fp32, ILP64). Row-major buffer handed
// to column-major LAPACK => LU of A^T.
////////////////////////////////////////////////////////////////////
if (boss) {
#ifdef GRID_HIP
std::cout << GridLogMessage << "DenseCoarseMatrix: rocSOLVER cgetrf_64 (ILP64 LU) N=" << N
<< " in place on resident device buffer" << std::endl;
rocblas_handle handle = GridBLASInverse::Handle();
int64_t *dInfo;
GRID_ASSERT( hipMalloc((void **)&dIpiv, N*sizeof(int64_t)) == hipSuccess );
GRID_ASSERT( hipMalloc((void **)&dInfo, sizeof(int64_t)) == hipSuccess );
auto st1 = rocsolver_cgetrf_64(handle, (int64_t)N, (int64_t)N, dA, (int64_t)N, dIpiv, dInfo);
hipDeviceSynchronize();
int64_t info_h = -1;
hipMemcpy(&info_h, dInfo, sizeof(int64_t), hipMemcpyDeviceToHost);
std::cout << GridLogMessage << "DenseCoarseMatrix: cgetrf_64 status " << (int)st1
<< " info = " << (int)info_h << std::endl;
GRID_ASSERT(st1 == rocblas_status_success);
GRID_ASSERT(info_h == 0);
hipFree(dInfo);
GRID_ASSERT( hipMalloc((void **)&dB, (uint64_t)CHUNKROWS*N*sizeof(ComplexF)) == hipSuccess );
// dA holds the LU of A^T; rows of A^{-1} are produced blockwise below via
// cgetrs_64 on identity-column blocks: A^T X = E => X columns = rows of
// A^{-1}, in exactly the linear layout the harvest expects.
#else
// Eigen fallback: small local CPU tests only.
std::cout << GridLogMessage << "DenseCoarseMatrix: Eigen fallback inversion N=" << N
<< (N > 10000 ? " (WARNING: SLOW; use the HIP/rocSOLVER path)" : "")
<< std::endl;
typedef Eigen::Matrix<std::complex<float>,Eigen::Dynamic,Eigen::Dynamic,Eigen::RowMajor> MatF;
Eigen::Map<MatF> A(reinterpret_cast<std::complex<float>*>(&Afull[0]), N, N);
MatF Ainv = A.inverse();
A = Ainv;
#endif
}
double t3 = usecond();
std::cout << GridLogMessage << "DenseCoarseMatrix: factorisation took "
<< (t3-t2)/1.0e6 << " s" << std::endl;
////////////////////////////////////////////////////////////////////
// Blocked solve + broadcast: rows of A^{-1} chunk by chunk; each
// rank keeps the rows of its own sites (ownership-aligned).
////////////////////////////////////////////////////////////////////
{
std::unordered_map<int64_t,int> rowmap;
for(int ss=0; ss<lsites; ss++)
for(int a=0; a<nbasis; a++)
rowmap[ myGsite[ss]*nbasis + a ] = ss*nbasis + a;
std::vector<ComplexF> chunk((uint64_t)CHUNKROWS * N);
for(int64_t row0=0; row0<N; row0+=CHUNKROWS){
int64_t nrow = std::min(CHUNKROWS, N-row0);
uint64_t nelem = (uint64_t)nrow * N;
if (boss) {
#ifdef GRID_HIP
// Identity block E: column j = e_{row0+j}; solve A^T X = E so X's
// columns are rows [row0,row0+nrow) of A^{-1}.
for(uint64_t i=0;i<nelem;i++) chunk[i] = ComplexF(0.0,0.0);
for(int64_t j=0;j<nrow;j++) chunk[(uint64_t)j*N + (uint64_t)(row0+j)] = ComplexF(1.0,0.0);
GRID_ASSERT( hipMemcpy(dB, &chunk[0], nelem*sizeof(ComplexF), hipMemcpyHostToDevice) == hipSuccess );
auto strs = rocsolver_cgetrs_64(GridBLASInverse::Handle(), rocblas_operation_none,
(int64_t)N, (int64_t)nrow,
dA, (int64_t)N, dIpiv, dB, (int64_t)N);
GRID_ASSERT(strs == rocblas_status_success);
hipDeviceSynchronize();
GRID_ASSERT( hipMemcpy(&chunk[0], dB, nelem*sizeof(ComplexF), hipMemcpyDeviceToHost) == hipSuccess );
#else
uint64_t src = (uint64_t)row0 * N;
for(uint64_t i=0;i<nelem;i++) chunk[i] = Afull[src+i];
#endif
}
grid->Broadcast(0, &chunk[0], nelem*sizeof(ComplexF));
for(int64_t r=row0; r<row0+nrow; r++){
auto it = rowmap.find(r);
if (it != rowmap.end()) {
uint64_t dst = (uint64_t)(it->second) * N;
uint64_t src = (uint64_t)(r-row0) * N;
for(int64_t j=0;j<N;j++) slab[dst+j] = chunk[src+j];
}
}
}
}
#ifdef GRID_HIP
if (boss) {
if (dA) hipFree(dA);
if (dB) hipFree(dB);
if (dIpiv) hipFree(dIpiv);
}
#endif
double t4 = usecond();
std::cout << GridLogMessage << "DenseCoarseMatrix: blocked getrs solve+scatter took "
<< (t4-t3)/1.0e6 << " s" << std::endl;
}
////////////////////////////////////////////////////////////////////
// CORE apply on packed data: hX[N x nr] (zero-filled, my sites only)
// -> allreduce -> split-K GEMM against the resident slab -> reduce
// partials -> hY[nrows x nr] (column major). Platform-agnostic:
// deviceVector + GridBLAS (Eigen fallback on CPU builds).
// fp32 allreduce is EXACT: zero-fill assembly gives every element
// exactly one contributing rank.
////////////////////////////////////////////////////////////////////
void SlabApplyPacked(int nr, double *tprof)
{
GRID_ASSERT(nr <= MRHS_MAX);
uint64_t nX = (uint64_t)N * nr;
uint64_t nY = (uint64_t)nrows * nr;
int64_t Kc = N / NK;
double t1 = usecond();
double t2, t3;
if (devSum) {
acceleratorCopyToDevice(&hX[0],&dX[0],nX*sizeof(ComplexF));
t2 = usecond();
grid->GlobalSumVector((ComplexF *)&dX[0], (int)nX);
t3 = usecond();
} else {
grid->GlobalSumVector(&hX[0], (int)nX);
t2 = usecond();
acceleratorCopyToDevice(&hX[0],&dX[0],nX*sizeof(ComplexF));
t3 = usecond();
}
// Y = op(slab,T) . X : row-major slab (nrows x N) == col-major A^T
// (N x nrows, lda=N) => transpose gives the nrows x N operator.
// Split-K: NK chunk-GEMMs by pointer offset (AOT lists), then reduce.
ComplexF one (1.0,0.0);
ComplexF zero(0.0,0.0);
BLAS.gemmBatched(GridBLAS_OP_T, GridBLAS_OP_N,
(int)nrows, nr, (int)Kc,
one, aptrs, (int)N,
xptrs, (int)N,
zero, cptrs, (int)nrows);
BLAS.synchronise();
{
ComplexF *pp = &dPartial[0];
ComplexF *py = &dY[0];
uint64_t stride = (uint64_t)nrows*MRHS_MAX;
int nk = NK;
accelerator_for(i, nY, 1, {
ComplexF acc(0.0,0.0);
for(int j=0;j<nk;j++) acc += pp[(uint64_t)j*stride + i];
py[i] = acc;
});
}
double t4 = usecond();
acceleratorCopyFromDevice(&dY[0],&hY[0],nY*sizeof(ComplexF));
double t5 = usecond();
if (tprof) {
tprof[0] = devSum ? (t3-t2) : (t2-t1); // allreduce
tprof[1] = devSum ? (t2-t1) : (t3-t2); // H2D
tprof[2] = t4-t3; // gemm+reduce
tprof[3] = t5-t4; // D2H
}
}
////////////////////////////////////////////////////////////////////
// Single-RHS apply (also the VERIFY path => certifies device slab).
////////////////////////////////////////////////////////////////////
virtual void operator()(const Field &src, Field &psi)
{
uint64_t nX = (uint64_t)N;
thread_for(i, nX, { hX[i]=ComplexF(0.0,0.0); });
for(int ss=0; ss<lsites; ss++){
sobj s;
peekLocalSite(s, src, myLcoor[ss]);
for(int b=0; b<nbasis; b++)
hX[ myGsite[ss]*nbasis + b ] = ComplexF(((ComplexD *)&s)[b]);
}
SlabApplyPacked(1, nullptr);
for(int ss=0; ss<lsites; ss++){
sobj s;
for(int b=0; b<nbasis; b++)
((ComplexD *)&s)[b] = ComplexD(hY[ss*nbasis + b]);
pokeLocalSite(s, psi, myLcoor[ss]);
}
if ( getenv("DENSE_CC_CHECK") ) {
Field tmp(grid);
_Op.M(psi, tmp);
tmp = tmp - src;
std::cout << GridLogMessage << "DenseCoarseMatrix: apply defect ||A x - b||/||b|| = "
<< std::sqrt(norm2(tmp)/norm2(src)) << std::endl;
}
}
////////////////////////////////////////////////////////////////////
// Batched (vector-of-fields) apply.
////////////////////////////////////////////////////////////////////
void ApplyBatch(std::vector<Field> &src, std::vector<Field> &psi)
{
int nr = src.size();
GRID_ASSERT(nr <= MRHS_MAX);
double t0 = usecond();
uint64_t nX = (uint64_t)N*nr;
thread_for(i, nX, { hX[i]=ComplexF(0.0,0.0); });
for(int rr=0; rr<nr; rr++){
for(int ss=0; ss<lsites; ss++){
sobj s;
peekLocalSite(s, src[rr], myLcoor[ss]);
for(int b=0; b<nbasis; b++)
hX[ (uint64_t)rr*N + myGsite[ss]*nbasis + b ] = ComplexF(((ComplexD *)&s)[b]);
}
}
SlabApplyPacked(nr, nullptr);
for(int rr=0; rr<nr; rr++){
for(int ss=0; ss<lsites; ss++){
sobj s;
for(int b=0; b<nbasis; b++)
((ComplexD *)&s)[b] = ComplexD(hY[(uint64_t)rr*nrows + (ss*nbasis+b)]);
pokeLocalSite(s, psi[rr], myLcoor[ss]);
}
}
double t1 = usecond();
std::cout << GridLogMessage << "DenseCoarseMatrix: batched apply " << nr << " rhs took "
<< (t1-t0)/1000.0 << " ms (" << (t1-t0)/1000.0/nr << " ms/rhs)" << std::endl;
if ( getenv("DENSE_CC_CHECK") ) {
Field tmp(grid);
for(int rr=0; rr<nr; rr++){
_Op.M(psi[rr], tmp);
tmp = tmp - src[rr];
std::cout << GridLogMessage << "DenseCoarseMatrix: batch defect["<<rr<<"] = "
<< std::sqrt(norm2(tmp)/norm2(src[rr])) << std::endl;
}
}
}
////////////////////////////////////////////////////////////////////
// 6D mrhs apply: operates DIRECTLY on the packed 6D field (rhs = dim 0).
////////////////////////////////////////////////////////////////////
void ApplyBatch6D(const Field &in6, Field &out6, int nr)
{
GRID_ASSERT(nr <= MRHS_MAX);
GRID_ASSERT(in6.Grid()->_ndimension == nd+1); // {rhs, s, x,y,z,t}
double t0 = usecond();
Field &in = const_cast<Field &>(in6);
uint64_t nX = (uint64_t)N * nr;
thread_for(i, nX, { hX[i]=ComplexF(0.0,0.0); });
{
autoView(iv, in, CpuRead);
Coordinate c6(nd+1);
for(int ss=0; ss<lsites; ss++){
for(int d=0; d<nd; d++) c6[d+1] = myLcoor[ss][d];
for(int rr=0; rr<nr; rr++){
c6[0] = rr;
sobj s;
peekLocalSite(s, iv, c6);
for(int b=0; b<nbasis; b++)
hX[(uint64_t)rr*N + myGsite[ss]*nbasis + b] = ComplexF(((ComplexD *)&s)[b]);
}
}
}
double t1 = usecond();
double tprof[4];
SlabApplyPacked(nr, tprof);
double t5 = usecond();
{
autoView(ov, out6, CpuWrite);
Coordinate c6(nd+1);
for(int ss=0; ss<lsites; ss++){
for(int d=0; d<nd; d++) c6[d+1] = myLcoor[ss][d];
for(int rr=0; rr<nr; rr++){
c6[0] = rr;
sobj s;
for(int b=0; b<nbasis; b++)
((ComplexD *)&s)[b] = ComplexD(hY[(uint64_t)rr*nrows + (ss*nbasis+b)]); // Y col-major
pokeLocalSite(s, ov, c6);
}
}
}
double t6 = usecond();
std::cout << GridLogMessage << "DenseCoarseMatrix: apply6D " << nr << " rhs took "
<< (t6-t0)/1000.0 << " ms" << std::endl;
if ( getenv("DENSE_APPLY_PROFILE") ) {
std::cout << GridLogMessage << "DenseCoarseMatrix: apply6D profile:"
<< " pack " << (t1-t0)/1000.0
<< " allreduce " << tprof[0]/1000.0
<< " H2D " << tprof[1]/1000.0
<< " gemm+reduce "<< tprof[2]/1000.0
<< " D2H " << tprof[3]/1000.0
<< " unpack " << (t6-t5)/1000.0
<< " ms" << std::endl;
}
}
};
NAMESPACE_END(Grid);
@@ -0,0 +1,133 @@
/*************************************************************************************
Grid physics library, www.github.com/paboyle/Grid
Source file: ./lib/qcd/action/pseudofermion/TwoFlavourBosonPseudoFermion.h
Copyright (C) 2026
Author: Peter Boyle <pboyle@bnl.gov>
This program is free software; you can redistribute it and/or modify
it under the terms of the GNU General Public License as published by
the Free Software Foundation; either version 2 of the License, or
(at your option) any later version.
This program is distributed in the hope that it will be useful,
but WITHOUT ANY WARRANTY; without even the implied warranty of
MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
GNU General Public License for more details.
You should have received a copy of the GNU General Public License along
with this program; if not, write to the Free Software Foundation, Inc.,
51 Franklin Street, Fifth Floor, Boston, MA 02110-1301 USA.
See the full license in the file "LICENSE" in the top level distribution directory
*************************************************************************************/
/* END LEGAL */
#pragma once
NAMESPACE_BEGIN(Grid);
///////////////////////////////////////////////////////////////////////////////
// Two flavour BOSON (wrong-sign) pseudofermion for any FermionOperator B:
//
// S2 = chi^dag Bdag B chi = |B chi|^2
//
// integral ==> det( Bdag B )^-1 = |det B|^-2
//
// A compensator monomial: supplies an INVERSE determinant with NO solve in
// the force or the action -- both are matrix multiplies. The only solve is
// the heatbath chi = B^-1 eta, once per trajectory (for B = the
// Pauli-Villars operator this is a mass-one solve, trivially cheap).
//
// Primary use: two instances with B = PV cancel the |det PV|^2 excess of
// TwoFlavourPVdagMPseudoFermionAction down to the DWF quotient
// |det M|^2/|det PV|^2 (two unsquared instances rather than one squared
// kernel: first powers of PV in the force, milder). Being generic in B it
// also serves Hasenbusch-chain compensation at intermediate masses, or any
// future inverse-det bookkeeping. (Sibling of the domain-decomposed boson
// in DomainDecomposedBoundaryTwoFlavourBosonPseudoFermion.h, without the
// boundary machinery.)
//
// Heatbath exact by construction: S2 after refresh = |B B^-1 eta|^2 = |eta|^2.
///////////////////////////////////////////////////////////////////////////////
template<class Impl>
class TwoFlavourBosonPseudoFermionAction : public Action<typename Impl::GaugeField> {
public:
INHERIT_IMPL_TYPES(Impl);
private:
FermionOperator<Impl> & BOp; // the operator whose |det|^-2 is supplied
LinearFunction<FermionField> &HeatbathSolver; // b -> B^-1 b (heatbath only)
FermionField Chi; // the pseudo fermion field for this trajectory
public:
TwoFlavourBosonPseudoFermionAction(FermionOperator<Impl> &_BOp,
LinearFunction<FermionField> & HS
) : BOp(_BOp),
HeatbathSolver(HS),
Chi(_BOp.FermionGrid())
{};
virtual std::string action_name(){return "TwoFlavourBosonPseudoFermionAction";}
virtual std::string LogParameters(){
std::stringstream sstream;
sstream << GridLogMessage << "["<<action_name()<<"] has no parameters" << std::endl;
return sstream.str();
}
virtual void refresh(const GaugeField &U, GridSerialRNG &sRNG, GridParallelRNG& pRNG) {
// P(chi) = e^{- chi^dag BdagB chi} ; chi = B^-1 eta ; P(eta) = e^{-eta^dag eta}
// e^{-x^2/2 sig^2} => sig^2 = 0.5 ; eta enters with width 1/sqrt(2).
RealD scale = std::sqrt(0.5);
FermionField eta(BOp.FermionGrid());
gaussian(pRNG,eta);
eta = eta * scale;
refresh(U,eta);
}
// Deterministic-noise variant (test hook):
// after this, S(U) == norm2(eta) exactly (to solver tolerance).
void refresh(const GaugeField &U, const FermionField &eta) {
BOp.ImportGauge(U);
Chi = Zero();
HeatbathSolver(eta,Chi); // Chi = B^-1 eta : the ONLY solve
std::cout << GridLogMessage << action_name() << " refresh |Chi|^2 = "<< norm2(Chi)<<std::endl;
}
//////////////////////////////////////////////////////
// S2 = |B chi|^2 -- matrix multiply only
//////////////////////////////////////////////////////
virtual RealD S(const GaugeField &U) {
BOp.ImportGauge(U);
FermionField w(BOp.FermionGrid());
BOp.M(Chi,w); // w = B chi
RealD action = norm2(w);
return action;
}
//////////////////////////////////////////////////////
// dS2 = chi^dag dBdag w + w^dag dB chi , w = B chi
// NO solves.
//////////////////////////////////////////////////////
virtual void deriv(const GaugeField &U,GaugeField & dSdU) {
BOp.ImportGauge(U);
FermionField w(BOp.FermionGrid());
GaugeField force(BOp.GaugeGrid());
BOp.M(Chi,w); // w = B chi
BOp.MDeriv(force, Chi, w, DaggerYes); dSdU = force;
BOp.MDeriv(force, w, Chi, DaggerNo ); dSdU = dSdU+force;
dSdU *= -1.0; // Grid action sign convention (cf TwoFlavourRatio.h)
};
};
NAMESPACE_END(Grid);
@@ -0,0 +1,264 @@
/*************************************************************************************
Grid physics library, www.github.com/paboyle/Grid
Source file: ./lib/qcd/action/pseudofermion/TwoFlavourRatio4DPseudoFermion.h
Copyright (C) 2026
Author: Peter Boyle <pboyle@bnl.gov>
This program is free software; you can redistribute it and/or modify
it under the terms of the GNU General Public License as published by
the Free Software Foundation; either version 2 of the License, or
(at your option) any later version.
This program is distributed in the hope that it will be useful,
but WITHOUT ANY WARRANTY; without even the implied warranty of
MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
GNU General Public License for more details.
You should have received a copy of the GNU General Public License along
with this program; if not, write to the Free Software Foundation, Inc.,
51 Franklin Street, Fifth Floor, Boston, MA 02110-1301 USA.
See the full license in the file "LICENSE" in the top level distribution directory
*************************************************************************************/
/* END LEGAL */
#pragma once
NAMESPACE_BEGIN(Grid);
///////////////////////////////////////////////////////////////////////////////
// Two flavour ratio with FOUR dimensional pseudofermion, UNpreconditioned
// (full grid) solves.
//
// Companion to TwoFlavourRatioEO4DPseudoFermion.h but with the solver
// plumbing exposed as LinearFunction<FermionField> objects that already
// know their operator -- the natural interface for the non-Hermitian
// multigrid GCR stack (PVdagM), which solves M and Mdag DIRECTLY rather
// than through SchurRedBlack normal equations.
//
// Why: with 5D pseudofermions the squared-operator formulation hands
// normal-equation solvers (MdagM)^-1 phi AND Mdag^-1 phi from ONE Krylov
// space; a direct solver must solve twice, halving its per-solve gain.
// The 4D pseudofermion action needs one M^-1 and one M^-dag solve per
// force evaluation FOR BOTH solver families, so the direct-solver gain
// carries through undiluted. In addition phi4 is Ls-agnostic, so the
// force can be evaluated with a reduced-Ls operator pair while the
// accept/reject uses full Ls (inexact force, exact action).
//
// Solver slots (all full-grid 5D LinearFunctions, solution overwritten,
// zero guess imposed internally):
// DerivMinvSolver : x = M^-1 b (DenOp)
// DerivMdagInvSolver : x = M^-dag b (DenOp). For G5R5-hermitian
// actions this may be implemented by the caller as
// G5R5 . DerivMinvSolver . G5R5 -- no adjoint
// multigrid needed.
// ActionMinvSolver : x = M^-1 b (DenOp, accept/reject tolerance)
// HeatbathVinvSolver : x = V^-1 b (NumOp)
//
// 4D <-> 5D wall maps: the action is S = | P (M^-1 V) Pdag phi4 |^2 where
// (P,Pdag) MUST be a mutually adjoint pair for S and deriv to be
// consistent. Two candidate conventions, selected by solution_walls:
// true : P = P_- psi(0) + P_+ psi(Ls-1) (solution walls, matches
// ExportPhysicalFermionSolution) and Pdag its literal adjoint.
// false : P = P_+ psi(0) + P_- psi(Ls-1) (source walls, Pdag matches
// ImportUnphysicalFermion).
// The heatbath is exact iff [P M^-1 V Pdag][P V^-1 M Pdag] = 1 (the 4D
// effective-operator composition identity); which convention satisfies it
// is settled numerically by the refresh test S == 0.5*|eta4|^2 exactly.
///////////////////////////////////////////////////////////////////////////////
template<class Impl>
class TwoFlavourRatio4DPseudoFermionAction : public Action<typename Impl::GaugeField> {
public:
INHERIT_IMPL_TYPES(Impl);
private:
typedef FermionOperator<Impl> FermOp;
FermionOperator<Impl> & NumOp;// the basic operator (V)
FermionOperator<Impl> & DenOp;// the basic operator (M)
LinearFunction<FermionField> &DerivMinvSolver;
LinearFunction<FermionField> &DerivMdagInvSolver;
LinearFunction<FermionField> &ActionMinvSolver;
LinearFunction<FermionField> &HeatbathVinvSolver;
FermionField phi4; // the pseudo fermion field for this trajectory
int solution_walls; // wall convention for the (P,Pdag) pair; see header
////////////////////////////////////////////////////////////////////
// The mutually adjoint 4D <-> 5D pair.
// Wall4D : q4 = P psi5 (extract)
// Wall4DAdj : psi5 = Pdag q4 (insert; literal adjoint of Wall4D)
////////////////////////////////////////////////////////////////////
void Wall4D(const FermionField &psi5, FermionField &q4)
{
int Ls = NumOp.FermionGrid()->_fdimensions[0];
FermionField tmp(NumOp.FermionGrid());
if ( solution_walls ) {
// q4 = P_- psi(0) + P_+ psi(Ls-1)
axpby_ssp_pminus(tmp, 0., psi5, 1., psi5, 0, 0);
axpby_ssp_pplus (tmp, 1., tmp , 1., psi5, 0, Ls-1);
} else {
// q4 = P_+ psi(0) + P_- psi(Ls-1)
axpby_ssp_pplus (tmp, 0., psi5, 1., psi5, 0, 0);
axpby_ssp_pminus(tmp, 1., tmp , 1., psi5, 0, Ls-1);
}
ExtractSlice(q4, tmp, 0, 0);
}
void Wall4DAdj(const FermionField &q4, FermionField &psi5)
{
int Ls = NumOp.FermionGrid()->_fdimensions[0];
FermionField tmp(NumOp.FermionGrid());
tmp = Zero();
InsertSlice(q4, tmp, 0 , 0);
InsertSlice(q4, tmp, Ls-1, 0);
if ( solution_walls ) {
// psi(0) = P_- q4 ; psi(Ls-1) = P_+ q4
axpby_ssp_pminus(tmp, 0., tmp, 1., tmp, 0 , 0);
axpby_ssp_pplus (tmp, 0., tmp, 1., tmp, Ls-1, Ls-1);
} else {
// psi(0) = P_+ q4 ; psi(Ls-1) = P_- q4
axpby_ssp_pplus (tmp, 0., tmp, 1., tmp, 0 , 0);
axpby_ssp_pminus(tmp, 0., tmp, 1., tmp, Ls-1, Ls-1);
}
psi5 = tmp;
}
public:
TwoFlavourRatio4DPseudoFermionAction(FermionOperator<Impl> &_NumOp,
FermionOperator<Impl> &_DenOp,
LinearFunction<FermionField> & DMS,
LinearFunction<FermionField> & DMDS,
LinearFunction<FermionField> & AMS,
LinearFunction<FermionField> & HVS,
int _solution_walls = 1
) : NumOp(_NumOp),
DenOp(_DenOp),
DerivMinvSolver(DMS),
DerivMdagInvSolver(DMDS),
ActionMinvSolver(AMS),
HeatbathVinvSolver(HVS),
phi4(_NumOp.GaugeGrid()),
solution_walls(_solution_walls)
{};
virtual std::string action_name(){return "TwoFlavourRatio4DPseudoFermionAction";}
virtual std::string LogParameters(){
std::stringstream sstream;
sstream << GridLogMessage << "["<<action_name()<<"] solution_walls " << solution_walls << std::endl;
return sstream.str();
}
virtual void refresh(const GaugeField &U, GridSerialRNG &sRNG, GridParallelRNG& pRNG) {
// P(phi4) = e^{- phi4^dag Beff^dag Beff phi4} ; Beff = P M^-1 V Pdag
//
// NumOp == V
// DenOp == M
//
// Take phi4 = P V^-1 M Pdag eta4 ( = Beff^-1 eta4 by the composition
// identity; verified numerically by S == 0.5 |eta4|^2 after refresh )
//
// P(eta) = e^{- eta^dag eta} ; e^{-x^2/2 sig^2} => sig^2 = 0.5
// so eta enters with width 1/sqrt(2).
//
RealD scale = std::sqrt(0.5);
FermionField eta4(NumOp.GaugeGrid());
FermionField eta5(NumOp.FermionGrid());
FermionField tmp (NumOp.FermionGrid());
FermionField phi5(NumOp.FermionGrid());
gaussian(pRNG,eta4);
NumOp.ImportGauge(U);
DenOp.ImportGauge(U);
Wall4DAdj(eta4,eta5); // eta5 = Pdag eta4
DenOp.M(eta5,tmp); // tmp = M eta5
phi5 = Zero();
HeatbathVinvSolver(tmp,phi5); // phi5 = V^-1 M eta5
Wall4D(phi5,phi4); // phi4 = P phi5
phi4 = phi4*scale;
std::cout << GridLogMessage << "4d pf (non-EO) refresh "<< norm2(phi4)<<"\n";
};
//////////////////////////////////////////////////////
// S = phi4^dag (Pdag^dag V^dag M^-dag P^dag) (P M^-1 V Pdag) phi4
// = | P M^-1 V Pdag phi4 |^2
//////////////////////////////////////////////////////
virtual RealD S(const GaugeField &U) {
NumOp.ImportGauge(U);
DenOp.ImportGauge(U);
FermionField Y4 (NumOp.GaugeGrid());
FermionField phi5(NumOp.FermionGrid());
FermionField X (NumOp.FermionGrid());
FermionField Y (NumOp.FermionGrid());
Wall4DAdj(phi4,phi5); // phi5 = Pdag phi4
NumOp.M(phi5,X); // X = V phi5
Y = Zero();
ActionMinvSolver(X,Y); // Y = M^-1 V phi5
Wall4D(Y,Y4); // Y4 = P Y
RealD action = norm2(Y4);
return action;
};
//////////////////////////////////////////////////////
// dS/du = 2 Re [ (M^-dag Pdag w4)^dag dV Pdag phi4 ]
// - 2 Re [ (M^-dag Pdag w4)^dag dM (M^-1 V Pdag phi4) ]
// with w4 = P M^-1 V Pdag phi4.
// Two first-power solves: one M^-1, one M^-dag.
//////////////////////////////////////////////////////
virtual void deriv(const GaugeField &U,GaugeField & dSdU) {
NumOp.ImportGauge(U);
DenOp.ImportGauge(U);
FermionField phi5 (NumOp.FermionGrid());
FermionField Vphi (NumOp.FermionGrid());
FermionField MinvVphi (NumOp.FermionGrid());
FermionField w4 (NumOp.GaugeGrid());
FermionField Y (NumOp.FermionGrid());
FermionField MdagInvPdagW (NumOp.FermionGrid());
GaugeField force(NumOp.GaugeGrid());
Wall4DAdj(phi4,phi5); // phi5 = Pdag phi4
NumOp.M(phi5,Vphi); // Vphi = V phi5
MinvVphi = Zero();
DerivMinvSolver(Vphi,MinvVphi); // MinvVphi = M^-1 V phi5
std::cout << GridLogMessage << "4d pf (non-EO) deriv solve "<< norm2(MinvVphi)<<"\n";
// Project onto the physical 4D subspace and back: Y = Pdag P MinvVphi.
// Pdag here MUST be the literal adjoint of the P used in S, else the
// force is inconsistent with the action.
Wall4D(MinvVphi,w4); // w4 = P MinvVphi
Wall4DAdj(w4,Y); // Y = Pdag w4
MdagInvPdagW = Zero();
DerivMdagInvSolver(Y,MdagInvPdagW); // = M^-dag Pdag w4 (adjoint solve)
std::cout << GridLogMessage << "4d pf (non-EO) deriv solve dag "<< norm2(MdagInvPdagW)<<"\n";
// phi^dag (Pdag' Vdag Mdag^-1 P') (dV) Pdag phi + h.c.
NumOp.MDeriv(force, MdagInvPdagW, phi5, DaggerNo ); dSdU=force;
NumOp.MDeriv(force, phi5, MdagInvPdagW, DaggerYes); dSdU=dSdU+force;
// - phi^dag ( ... Mdag^-1 ) dM ( M^-1 V ... ) phi + h.c.
DenOp.MDeriv(force, MdagInvPdagW, MinvVphi, DaggerNo ); dSdU=dSdU-force;
DenOp.MDeriv(force, MinvVphi, MdagInvPdagW, DaggerYes); dSdU=dSdU-force;
dSdU *= -1.0;
};
};
NAMESPACE_END(Grid);
@@ -0,0 +1,206 @@
/*************************************************************************************
Grid physics library, www.github.com/paboyle/Grid
Source file: ./lib/qcd/action/pseudofermion/TwoFlavourRatioLeftPrec.h
Copyright (C) 2026
Author: Peter Boyle <pboyle@bnl.gov>
This program is free software; you can redistribute it and/or modify
it under the terms of the GNU General Public License as published by
the Free Software Foundation; either version 2 of the License, or
(at your option) any later version.
This program is distributed in the hope that it will be useful,
but WITHOUT ANY WARRANTY; without even the implied warranty of
MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
GNU General Public License for more details.
You should have received a copy of the GNU General Public License along
with this program; if not, write to the Free Software Foundation, Inc.,
51 Franklin Street, Fifth Floor, Boston, MA 02110-1301 USA.
See the full license in the file "LICENSE" in the top level distribution directory
*************************************************************************************/
/* END LEGAL */
#pragma once
NAMESPACE_BEGIN(Grid);
///////////////////////////////////////////////////////////////////////////////
// Two flavour ratio with LEFT-PRECONDITIONED solves.
//
// Same action content as TwoFlavourRatio.h:
//
// S = phi^dag V (Mdag M)^-1 Vdag phi ==> det[ Mdag M / Vdag V ]
//
// (V = NumOp the heavier / Pauli-Villars operator, M = DenOp the lighter),
// but organised around the composite
//
// F = Vdag M
//
// which is the 2-hop-coarsenable operator the non-Hermitian multigrid
// serves. Solving M X = b as F X = Vdag b is LEFT PRECONDITIONING by
// Vdag; the determinant/action layer is the standard quotient, and all
// novelty is confined to the solver contract.
//
// TwoFlavourRatio.h is tied to a normal-equations solver: one (MdagM)^-1
// solve, then Y = M X gives Mdag^-1 Vdag phi almost free. The left-
// preconditioned idiom is DIFFERENT: the chain
//
// b = Vdag phi
// z : Fdag z = b (adjoint F solve)
// Y = V z (= Mdag^-1 Vdag phi -- harvested from solve 1)
// s = Vdag Y (= Vdag V z)
// X : F X = s (forward F solve; X = (MdagM)^-1 Vdag phi)
//
// yields Y BEFORE X (so S(U) needs only the adjoint solve), with Y's
// accuracy independent of the second solve. Force terms are then the
// standard four MDeriv insertions of TwoFlavourRatio.
//
// Solver slots are LinearFunctions with the F-SOLVE contract (solution
// overwritten, zero guess imposed internally):
// ForwardSolver(b,x) : F x = b
// AdjointSolver(b,z) : Fdag z = b
// implemented in production by the multigrid-GCR stack (forward cycle and
// adjoint cycle); in tests by CG on the composite normal equations.
// HeatbathSolver(b,x) : x = (Vdag V)^-1 b -- heavy operator, plain CG.
//
// Heatbath is exact by operator algebra: phi = V (VdagV)^-1 Mdag eta
// ==> S = | Mdag^-1 Vdag phi |^2 = |eta|^2 (to solver tolerance); the
// deterministic refresh(U,eta) hook below is the test point.
//
// Hasenbusch: nothing requires V to have mass one; any (heavier,lighter)
// pair works, F(V,M) = Vdag M coarsenable by the same machinery, rungs'
// solves are F-family (mrhs-batchable, mass-shared coarse space).
///////////////////////////////////////////////////////////////////////////////
template<class Impl>
class TwoFlavourRatioLeftPrecPseudoFermionAction : public Action<typename Impl::GaugeField> {
public:
INHERIT_IMPL_TYPES(Impl);
private:
FermionOperator<Impl> & NumOp;// V
FermionOperator<Impl> & DenOp;// M
LinearFunction<FermionField> &DerivForwardSolver; // F x = b, MD tolerance
LinearFunction<FermionField> &DerivAdjointSolver; // Fdag z = b, MD tolerance
LinearFunction<FermionField> &ActionAdjointSolver; // Fdag z = b, accept/reject tolerance
LinearFunction<FermionField> &HeatbathSolver; // (VdagV)^-1 b, heavy op
FermionField Phi; // the pseudo fermion field for this trajectory
public:
TwoFlavourRatioLeftPrecPseudoFermionAction(FermionOperator<Impl> &_NumOp,
FermionOperator<Impl> &_DenOp,
LinearFunction<FermionField> & DFS,
LinearFunction<FermionField> & DAS,
LinearFunction<FermionField> & AAS,
LinearFunction<FermionField> & HS
) : NumOp(_NumOp),
DenOp(_DenOp),
DerivForwardSolver(DFS),
DerivAdjointSolver(DAS),
ActionAdjointSolver(AAS),
HeatbathSolver(HS),
Phi(_NumOp.FermionGrid())
{};
virtual std::string action_name(){return "TwoFlavourRatioLeftPrecPseudoFermionAction";}
virtual std::string LogParameters(){
std::stringstream sstream;
sstream << GridLogMessage << "["<<action_name()<<"] has no parameters" << std::endl;
return sstream.str();
}
virtual void refresh(const GaugeField &U, GridSerialRNG &sRNG, GridParallelRNG& pRNG) {
// P(phi) = e^{- phi^dag V (MdagM)^-1 Vdag phi} ; phi = Vdag^-1 Mdag eta
// e^{-x^2/2 sig^2} => sig^2 = 0.5 ; eta enters with width 1/sqrt(2).
RealD scale = std::sqrt(0.5);
FermionField eta(NumOp.FermionGrid());
gaussian(pRNG,eta);
eta = eta * scale;
refresh(U,eta);
}
// Deterministic-noise variant (test hook):
// after this, S(U) == norm2(eta) exactly (to solver tolerance).
void refresh(const GaugeField &U, const FermionField &eta) {
NumOp.ImportGauge(U);
DenOp.ImportGauge(U);
FermionField tmp(NumOp.FermionGrid());
FermionField w (NumOp.FermionGrid());
DenOp.Mdag(eta,tmp); // tmp = Mdag eta
w = Zero();
HeatbathSolver(tmp,w); // w = (VdagV)^-1 Mdag eta
NumOp.M(w,Phi); // Phi = V (VdagV)^-1 Mdag eta = Vdag^-1 Mdag eta
std::cout << GridLogMessage << action_name() << " refresh |Phi|^2 = "<< norm2(Phi)<<std::endl;
}
//////////////////////////////////////////////////////
// S = phi^dag V (MdagM)^-1 Vdag phi = | Mdag^-1 Vdag phi |^2
// ONE adjoint F solve: Y = V Fdag^-1 Vdag phi = Mdag^-1 Vdag phi
//////////////////////////////////////////////////////
virtual RealD S(const GaugeField &U) {
NumOp.ImportGauge(U);
DenOp.ImportGauge(U);
FermionField b(NumOp.FermionGrid());
FermionField z(NumOp.FermionGrid());
FermionField Y(NumOp.FermionGrid());
NumOp.Mdag(Phi,b); // b = Vdag phi
z = Zero();
ActionAdjointSolver(b,z); // Fdag z = b
NumOp.M(z,Y); // Y = V z = Mdag^-1 Vdag phi
RealD action = norm2(Y);
return action;
}
//////////////////////////////////////////////////////
// dS/du = phi^dag dV (MdagM)^-1 Vdag phi
// - phi^dag V (MdagM)^-1 [ Mdag dM + dMdag M ] (MdagM)^-1 Vdag phi
// + phi^dag V (MdagM)^-1 dVdag phi
// Identical force insertions to TwoFlavourRatio.h; X and Y from the
// left-preconditioned chain (Y harvested from the adjoint solve).
//////////////////////////////////////////////////////
virtual void deriv(const GaugeField &U,GaugeField & dSdU) {
NumOp.ImportGauge(U);
DenOp.ImportGauge(U);
FermionField b(NumOp.FermionGrid());
FermionField z(NumOp.FermionGrid());
FermionField Y(NumOp.FermionGrid());
FermionField s(NumOp.FermionGrid());
FermionField X(NumOp.FermionGrid());
GaugeField force(NumOp.GaugeGrid());
NumOp.Mdag(Phi,b); // b = Vdag phi
z = Zero();
DerivAdjointSolver(b,z); // Fdag z = b
NumOp.M(z,Y); // Y = V z = Mdag^-1 Vdag phi (solve-1 harvest)
NumOp.Mdag(Y,s); // s = Vdag V z
X = Zero();
DerivForwardSolver(s,X); // F X = s ==> X = (MdagM)^-1 Vdag phi
// phi^dag V (MdagM)^-1 dVdag phi
NumOp.MDeriv(force , X, Phi, DaggerYes); dSdU = force;
// phi^dag dV (MdagM)^-1 Vdag phi
NumOp.MDeriv(force , Phi, X, DaggerNo ); dSdU = dSdU+force;
// - phi^dag V (MdagM)^-1 Mdag dM (MdagM)^-1 Vdag phi
// - phi^dag V (MdagM)^-1 dMdag M (MdagM)^-1 Vdag phi
DenOp.MDeriv(force, Y, X, DaggerNo ); dSdU = dSdU-force;
DenOp.MDeriv(force, X, Y, DaggerYes); dSdU = dSdU-force;
dSdU *= -1.0;
};
};
NAMESPACE_END(Grid);
@@ -0,0 +1,663 @@
/*************************************************************************************
Grid physics library, www.github.com/paboyle/Grid
Source file: ./examples/Example_pvdagm_mrhs_3level_DenseCoarseMatrix.cc
Copyright (C) 2026
Author: Peter Boyle <pboyle@bnl.gov>
This program is free software; you can redistribute it and/or modify
it under the terms of the GNU General Public License as published by
the Free Software Foundation; either version 2 of the License, or
(at your option) any later version.
See the full license in the file "LICENSE" in the top level distribution directory
*************************************************************************************/
/* END LEGAL */
// MultiRHS (valence) THREE-level multigrid for PVdagM with a DENSE, EXACT,
// non-iterative coarse-coarse bottom -- the LIBRARY-CLASS successor of
// Example_pvdagm_mrhs_3level_dense.cc, which is FROZEN as the regression
// baseline / champion-provenance artifact (21.7 s/RHS at BLOCK=2.2.3.3,
// BLOCK2=8.4.2.4, nb60, CSO3/FSO6/CST0.04 on 36 Frontier nodes).
//
// The dense bottom is now Grid/algorithms/multigrid/DenseCoarseMatrix.h:
// - stencil -> dense DIRECT import (no probe assembly: rows are local data)
// + IMPORT CERTIFICATE (DENSE_IMPORT_SIGN=-1 flips convention, no rebuild)
// - split-K apply via GridBLAS.gemmBatched with explicit leading dimensions
// (DENSE_SPLITK chunks, default 32) -- the fig-11 software split-K
// - deviceVector / GridBLAS throughout the apply: platform-agnostic
//
// INTERCHANGE: same SLAB_FILE per-rank format as the frozen example (stem MUST
// encode cfg/mass/blocking/nbasis; the header guards only N/nrows/nbasis) and
// the same env-var set, so existing sbatch scripts drive either binary.
//
// A/B acceptance (old binary = control):
// slab-cached : outer counts match EXACTLY (identical apply data; split-K
// changes only fp32 reduction order); wall delta = split-K gain.
// fresh setup : outer equal-or-+-1 (import vs probe = rounding); VERIFY
// ~7e-4 both; setup delta = import gain (~93 s probe retired).
//
// Level structure, solvers, and tuning knobs are UNCHANGED from the frozen
// example. Env: MASS SUBSPACE_FILE NRHS BLOCK BLOCK2 FineSmootherShift/Order
// CoarseSmootherShift/Nstep CoarseSolverTol/Order DENSE_CC DENSE_CC_CHECK
// DENSE_SPLITK DENSE_DEVICE_SUM DENSE_IMPORT_SIGN DENSE_APPLY_PROFILE
// L3_TOL L3_MAXIT L3_NSTEP OuterMmax OuterNstep OuterTol
#include <Grid/Grid.h>
#include <Grid/lattice/PaddedCell.h>
#include <Grid/stencil/GeneralLocalStencil.h>
#include <Grid/algorithms/iterative/PrecGeneralisedConjugateResidualNonHermitian.h>
#include <Grid/algorithms/multigrid/DenseCoarseMatrix.h>
#include <memory>
using namespace std;
using namespace Grid;
RealD FineSmootherShift = 0.1;
int FineSmootherOrder = 16;
RealD CoarseSmootherShift = 0.1;
int CoarseSmootherNstep = 4;
RealD CoarseSolverTol = 0.03;
int CoarseSolverOrder = 200;
RealD L3Tol = 2.5e-1;
int L3MaxIt = 50;
int L3Nstep = 50;
RealD OuterTol = 1.0e-8;
int OuterMmax = 8;
int OuterNstep = 8;
int Nrhs = 12;
int UseDenseCC = 1;
RealD mass = 0.00078;
void ParseEnvironment(void)
{
if(getenv("MASS")) mass = atof(getenv("MASS"));
if(getenv("FineSmootherShift")) FineSmootherShift = atof(getenv("FineSmootherShift"));
if(getenv("FineSmootherOrder")) FineSmootherOrder = atoi(getenv("FineSmootherOrder"));
if(getenv("CoarseSmootherShift"))CoarseSmootherShift= atof(getenv("CoarseSmootherShift"));
if(getenv("CoarseSmootherNstep"))CoarseSmootherNstep= atoi(getenv("CoarseSmootherNstep"));
if(getenv("CoarseSolverTol")) CoarseSolverTol = atof(getenv("CoarseSolverTol"));
if(getenv("CoarseSolverOrder")) CoarseSolverOrder = atoi(getenv("CoarseSolverOrder"));
if(getenv("L3_TOL")) L3Tol = atof(getenv("L3_TOL"));
if(getenv("L3_MAXIT")) L3MaxIt = atoi(getenv("L3_MAXIT"));
if(getenv("L3_NSTEP")) L3Nstep = atoi(getenv("L3_NSTEP"));
if(getenv("OuterTol")) OuterTol = atof(getenv("OuterTol"));
if(getenv("OuterMmax")) OuterMmax = atoi(getenv("OuterMmax"));
if(getenv("OuterNstep")) OuterNstep = atoi(getenv("OuterNstep"));
if(getenv("NRHS")) Nrhs = atoi(getenv("NRHS"));
if(getenv("DENSE_CC")) UseDenseCC = atoi(getenv("DENSE_CC"));
std::cout << GridLogMessage << "PARAM: MASS " << mass << std::endl;
std::cout << GridLogMessage << "PARAM: NRHS " << Nrhs << std::endl;
std::cout << GridLogMessage << "PARAM: DENSE_CC " << UseDenseCC << std::endl;
std::cout << GridLogMessage << "PARAM: FineSmootherShift " << FineSmootherShift << std::endl;
std::cout << GridLogMessage << "PARAM: FineSmootherOrder " << FineSmootherOrder << std::endl;
std::cout << GridLogMessage << "PARAM: CoarseSmootherShift" << CoarseSmootherShift<< std::endl;
std::cout << GridLogMessage << "PARAM: CoarseSmootherNstep" << CoarseSmootherNstep<< std::endl;
std::cout << GridLogMessage << "PARAM: CoarseSolverTol " << CoarseSolverTol << std::endl;
std::cout << GridLogMessage << "PARAM: CoarseSolverOrder " << CoarseSolverOrder << std::endl;
std::cout << GridLogMessage << "PARAM: L3_TOL " << L3Tol << std::endl;
std::cout << GridLogMessage << "PARAM: OuterMmax " << OuterMmax << std::endl;
std::cout << GridLogMessage << "PARAM: OuterNstep " << OuterNstep << std::endl;
}
template <class Field>
void saveSubspace(std::vector<Field> &subspace, std::string const fname){
#ifdef HAVE_LIME
Grid::emptyUserRecord record;
Grid::ScidacWriter SW(subspace[0].Grid()->IsBoss());
SW.open(fname);
for (int k = 0; k < (int)subspace.size(); k++) SW.writeScidacFieldRecord(subspace[k], record);
SW.close();
#endif
}
template <class Field>
void loadSubspace(std::vector<Field> &subspace, std::string const fname){
#ifdef HAVE_LIME
Grid::emptyUserRecord record;
Grid::ScidacReader SR;
SR.open(fname);
for (int k = 0; k < (int)subspace.size(); k++) SR.readScidacFieldRecord(subspace[k], record);
SR.close();
#endif
}
//////////////////////////////////////////////////////////////////////
// A = PV^dag M (non-Hermitian), and shifted variant for smoothers.
//////////////////////////////////////////////////////////////////////
template<class Matrix,class Field>
class PVdagMLinearOperator : public LinearOperatorBase<Field> {
Matrix &_Mat; Matrix &_PV;
public:
PVdagMLinearOperator(Matrix &Mat,Matrix &PV): _Mat(Mat),_PV(PV) {};
void OpDiag (const Field &in, Field &out) { assert(0); }
void OpDir (const Field &in, Field &out,int dir,int disp) { assert(0); }
void OpDirAll (const Field &in, std::vector<Field> &out){ assert(0); };
void Op (const Field &in, Field &out){ Field tmp(in.Grid()); _Mat.M(in,tmp); _PV.Mdag(tmp,out); }
void AdjOp (const Field &in, Field &out){ Field tmp(in.Grid()); _PV.M(in,tmp); _Mat.Mdag(tmp,out); }
void HermOpAndNorm(const Field &in, Field &out,RealD &n1,RealD &n2){ HermOp(in,out); ComplexD d=innerProduct(in,out); n1=real(d); n2=norm2(out); }
void HermOp(const Field &in, Field &out){ Field tmp(in.Grid()); Op(in,tmp); AdjOp(tmp,out); }
};
template<class Matrix,class Field>
class ShiftedPVdagMLinearOperator : public LinearOperatorBase<Field> {
Matrix &_Mat; Matrix &_PV;
public:
RealD shift;
ShiftedPVdagMLinearOperator(RealD _shift,Matrix &Mat,Matrix &PV): shift(_shift),_Mat(Mat),_PV(PV){};
void OpDiag (const Field &in, Field &out) { assert(0); }
void OpDir (const Field &in, Field &out,int dir,int disp) { assert(0); }
void OpDirAll (const Field &in, std::vector<Field> &out){ assert(0); };
void Op (const Field &in, Field &out){ Field tmp(in.Grid()); _Mat.M(in,tmp); _PV.Mdag(tmp,out); out = out + shift*in; }
void AdjOp (const Field &in, Field &out){ Field tmp(in.Grid()); _PV.M(tmp,out); _Mat.Mdag(in,tmp); out = out + shift*in; }
void HermOpAndNorm(const Field &in, Field &out,RealD &n1,RealD &n2){ assert(0); }
void HermOp(const Field &in, Field &out){ Field tmp(in.Grid()); Op(in,tmp); AdjOp(tmp,out); }
};
// Generic shift wrapper (for the coarse-level smoother on the 6D mrhs coarse operator).
template<class Field>
class ShiftedLinearOperator : public LinearOperatorBase<Field> {
LinearOperatorBase<Field> &_Op; RealD shift;
public:
ShiftedLinearOperator(RealD _shift, LinearOperatorBase<Field> &Op) : _Op(Op), shift(_shift) {}
void OpDiag (const Field &in, Field &out) { assert(0); }
void OpDir (const Field &in, Field &out,int dir,int disp) { assert(0); }
void OpDirAll (const Field &in, std::vector<Field> &out) { assert(0); }
void Op (const Field &in, Field &out) { _Op.Op(in,out); out = out + shift*in; }
void AdjOp (const Field &in, Field &out) { _Op.AdjOp(in,out); out = out + shift*in; }
void HermOpAndNorm(const Field &in, Field &out,RealD &n1,RealD &n2){ assert(0); }
void HermOp (const Field &in, Field &out) { Field tmp(in.Grid()); Op(in,tmp); AdjOp(tmp,out); }
};
//////////////////////////////////////////////////////////////////////
// Dense CC solve on the PACKED 6D mrhs coarse-coarse field: drop-in
// for the L3 PGCR, delegating to the library DenseCoarseMatrix.
//////////////////////////////////////////////////////////////////////
template<class DenseType, class CoarseCoarseField>
class MrhsDenseCCSolve : public LinearFunction<CoarseCoarseField> {
public:
DenseType &_Dense;
GridBase *_CoarseCoarse5d;
int _nrhs;
MrhsDenseCCSolve(DenseType &D, GridBase *cc5d, int nrhs)
: _Dense(D), _CoarseCoarse5d(cc5d), _nrhs(nrhs) {}
using LinearFunction<CoarseCoarseField>::operator();
virtual void operator()(const CoarseCoarseField &in, CoarseCoarseField &out){
if ( getenv("DENSE_CC_CHECK") ) {
// Audit path: per-rhs 5D unpack so ApplyBatch can run the _Op defect
// check per rhs. ~50ms/call of slice/split overhead -- audit only.
CoarseCoarseField tmp(in.Grid());
tmp = in;
std::vector<CoarseCoarseField> split_in (_nrhs,_CoarseCoarse5d);
std::vector<CoarseCoarseField> split_out(_nrhs,_CoarseCoarse5d);
for(int r=0;r<_nrhs;r++) ExtractSliceFast(split_in[r], tmp, r, 0);
_Dense.ApplyBatch(split_in, split_out);
for(int r=0;r<_nrhs;r++) InsertSliceFast(split_out[r], out, r, 0);
} else {
_Dense.ApplyBatch6D(in, out, _nrhs);
}
}
};
//////////////////////////////////////////////////////////////////////
// mrhs interfaces + single-polynomial mrhs PGCR (verbatim from the
// frozen Example_pvdagm_mrhs_3level_dense.cc)
//////////////////////////////////////////////////////////////////////
template<class Field>
class MrhsLinearFunction {
public:
virtual void operator()(std::vector<Field> &in, std::vector<Field> &out) = 0;
};
template<class Field>
class MrhsPGCRNonHermitian {
public:
RealD Tolerance; Integer MaxIterations; int mmax,nstep,steps,level;
int ZeroGuess = 0; int FirstCycle = 0; // caller contract: zero guess => first-cycle r0 = src
std::string name = "Level 1";
LinearOperatorBase<Field> &Linop;
MrhsLinearFunction<Field> &Preconditioner;
void Level(int lv){ name = "Level " + std::to_string(lv); level=lv; }
void Name(std::string n){ name = n; }
void SetZeroGuess(int z){ ZeroGuess=z; }
MrhsPGCRNonHermitian(RealD tol,Integer maxit,LinearOperatorBase<Field> &_Linop,MrhsLinearFunction<Field> &Prec,int _mmax,int _nstep)
: Tolerance(tol),MaxIterations(maxit),Linop(_Linop),Preconditioner(Prec),mmax(_mmax),nstep(_nstep){ level=1; }
static RealD vnorm2(std::vector<Field> &x){ RealD s=0; for(auto &f:x) s+=norm2(f); return s; }
static ComplexD vinnerProduct(std::vector<Field> &x,std::vector<Field> &y){ ComplexD s(0); for(int r=0;r<(int)x.size();r++) s+=innerProduct(x[r],y[r]); return s; }
static void vaxpy(std::vector<Field> &z,ComplexD a,std::vector<Field> &x,std::vector<Field> &y){ for(int r=0;r<(int)z.size();r++) axpy(z[r],a,x[r],y[r]); }
void vOp(std::vector<Field> &in,std::vector<Field> &out){ for(int r=0;r<(int)in.size();r++) Linop.Op(in[r],out[r]); }
void operator()(std::vector<Field> &src,std::vector<Field> &psi){
RealD cp,ssq,rsq; int nrhs=src.size(); GridBase *grid=src[0].Grid();
ssq=vnorm2(src); rsq=Tolerance*Tolerance*ssq;
std::vector<Field> r(nrhs,grid);
GridStopWatch T; T.Start(); steps=0; FirstCycle=1;
for(int k=0;k<MaxIterations;k++){
cp=GCRnStep(src,psi,rsq);
std::cout<<GridLogMessage<<std::string(level,'\t')<<" "<<name<<" MrhsPGCR("<<mmax<<","<<nstep<<") "<<steps<<" steps cp = "<<cp<<" target "<<rsq<<std::endl;
if(cp<rsq){
T.Stop(); vOp(psi,r); for(int rr=0;rr<nrhs;rr++) axpy(r[rr],-1.0,src[rr],r[rr]);
RealD tr=vnorm2(r);
std::cout<<GridLogMessage<<std::string(level,'\t')<<" "<<name<<" MrhsPGCR: Converged on iteration "<<steps
<<" computed residual "<<std::sqrt(cp/ssq)<<" true residual "<<std::sqrt(tr/ssq)<<" target "<<Tolerance<<std::endl;
std::cout<<GridLogMessage<<std::string(level,'\t')<<" "<<name<<" MrhsPGCR Time elapsed: Total "<<T.Elapsed()<<std::endl;
for(int rr=0;rr<nrhs;rr++){ RealD rn=std::sqrt(norm2(r[rr])/norm2(src[rr])); std::cout<<GridLogMessage<<"MrhsPGCR per-rhs true residual["<<rr<<"] = "<<rn<<std::endl; }
return;
}
}
std::cout<<GridLogMessage<<"MrhsPGCR: did not converge"<<std::endl;
}
RealD GCRnStep(std::vector<Field> &src,std::vector<Field> &psi,RealD rsq){
RealD cp; ComplexD a,b,rq; RealD zAAz; int nrhs=src.size(); GridBase *grid=src[0].Grid();
std::vector<Field> r(nrhs,grid),z(nrhs,grid),Az(nrhs,grid);
std::vector< std::vector<Field> > q(mmax,std::vector<Field>(nrhs,grid));
std::vector< std::vector<Field> > p(mmax,std::vector<Field>(nrhs,grid));
std::vector<RealD> qq(mmax);
std::cout<<GridLogMessage<<std::string(level,'\t')<<" "<<name<<" MrhsPGCR nStep("<<nstep<<")"<<std::endl;
if (ZeroGuess && FirstCycle) { for(int rr=0;rr<nrhs;rr++){ psi[rr]=Zero(); r[rr]=src[rr]; } }
else { vOp(psi,Az); for(int rr=0;rr<nrhs;rr++) r[rr]=src[rr]-Az[rr]; }
FirstCycle=0;
Preconditioner(r,z); vOp(z,Az); zAAz=vnorm2(Az);
p[0]=z; q[0]=Az; qq[0]=zAAz; cp=vnorm2(r);
for(int k=0;k<nstep;k++){
steps++; int kp=k+1, peri_k=k%mmax, peri_kp=kp%mmax;
rq=vinnerProduct(q[peri_k],r); a=rq/qq[peri_k];
vaxpy(psi,a,p[peri_k],psi); vaxpy(r,-a,q[peri_k],r); cp=vnorm2(r);
std::cout<<GridLogMessage<<std::string(level,'\t')<<" "<<name<<" MrhsPGCR step["<<steps<<"] resid "<<cp<<" target "<<rsq<<std::endl;
if((k==nstep-1)||(cp<rsq)) return cp;
Preconditioner(r,z); vOp(z,Az); zAAz=vnorm2(Az);
q[peri_kp]=Az; p[peri_kp]=z;
int northog=((kp)>(mmax-1))?(mmax-1):(kp);
for(int back=0;back<northog;back++){ int peri_back=(k-back)%mmax; GRID_ASSERT((k-back)>=0);
b=-real(vinnerProduct(q[peri_back],Az))/qq[peri_back];
vaxpy(p[peri_kp],b,p[peri_back],p[peri_kp]); vaxpy(q[peri_kp],b,q[peri_back],q[peri_kp]); }
qq[peri_kp]=vnorm2(q[peri_kp]);
}
GRID_ASSERT(0); return cp;
}
};
//////////////////////////////////////////////////////////////////////
// L2->L3 mrhs V-cycle: LinearFunction on the 6D mrhs COARSE field.
// The coarse-coarse solve slot takes EITHER the dense mrhs solve
// (DENSE_CC=1) or the L3 PGCR (DENSE_CC=0).
//////////////////////////////////////////////////////////////////////
template<class CoarseField, class CoarseCoarseField>
class MrhsCoarseThreeLevelPrec : public LinearFunction<CoarseField> {
public:
LinearOperatorBase<CoarseField> &_CoarseOp; // mrhs coarse op (6D)
LinearFunction<CoarseField> &_CoarseSmoother; // shifted 6D coarse smoother
MultiRHSBlockProject<CoarseField> &_Projector; // L2->L3 (vector-based)
LinearFunction<CoarseCoarseField> &_CoarseCoarseSolve; // L3 solve (6D cc)
GridBase *_Coarse5d, *_CoarseCoarse5d, *_CoarseCoarseMrhs;
int _nrhs;
MrhsCoarseThreeLevelPrec(LinearOperatorBase<CoarseField> &CoarseOp,
LinearFunction<CoarseField> &CoarseSmoother,
MultiRHSBlockProject<CoarseField> &Projector,
LinearFunction<CoarseCoarseField> &CoarseCoarseSolve,
GridBase *Coarse5d, GridBase *CoarseCoarse5d, GridBase *CoarseCoarseMrhs, int nrhs)
: _CoarseOp(CoarseOp), _CoarseSmoother(CoarseSmoother), _Projector(Projector),
_CoarseCoarseSolve(CoarseCoarseSolve),
_Coarse5d(Coarse5d), _CoarseCoarse5d(CoarseCoarse5d), _CoarseCoarseMrhs(CoarseCoarseMrhs), _nrhs(nrhs) {}
using LinearFunction<CoarseField>::operator();
virtual void operator()(const CoarseField &in, CoarseField &out) {
int nrhs=_nrhs; double t;
CoarseField vec1(in.Grid());
CoarseField vec2(in.Grid());
// trivial pre-smoother
out = in;
// residual (6D coarse)
_CoarseOp.Op(out,vec1); sub(vec1,in,vec1);
// restrict: unpack 6D coarse -> vector<Coarse> -> blockProject -> vector<CoarseCoarse> -> pack 6D cc
std::vector<CoarseField> csplit(nrhs,_Coarse5d);
std::vector<CoarseCoarseField> ccsplit(nrhs,_CoarseCoarse5d);
CoarseCoarseField CCsrc(_CoarseCoarseMrhs);
CoarseCoarseField CCsol(_CoarseCoarseMrhs);
t=-usecond();
for(int r=0;r<nrhs;r++) ExtractSliceFast(csplit[r],vec1,r,0);
_Projector.blockProject(csplit,ccsplit);
for(int r=0;r<nrhs;r++) InsertSliceFast(ccsplit[r],CCsrc,r,0);
t+=usecond();
std::cout<<GridLogMessage<<"L2->L3 restrict took "<<t/1000.0<<"ms"<<std::endl;
// L3 solve (dense mrhs GEMM, or PGCR)
t=-usecond();
CCsol=Zero();
_CoarseCoarseSolve(CCsrc,CCsol);
t+=usecond();
std::cout<<GridLogMessage<<"L3 coarse-coarse solve took "<<t/1000.0<<"ms ("<<t/1000.0/nrhs<<"ms/rhs)"<<std::endl;
// prolong: unpack 6D cc -> blockPromote -> pack 6D coarse; add correction
t=-usecond();
for(int r=0;r<nrhs;r++) ExtractSliceFast(ccsplit[r],CCsol,r,0);
_Projector.blockPromote(csplit,ccsplit);
for(int r=0;r<nrhs;r++) InsertSliceFast(csplit[r],vec1,r,0);
add(out,out,vec1);
t+=usecond();
std::cout<<GridLogMessage<<"L2->L3 prolong took "<<t/1000.0<<"ms"<<std::endl;
// residual + coarse smoother (6D coarse)
_CoarseOp.Op(out,vec1); sub(vec1,in,vec1);
vec2=Zero();
_CoarseSmoother(vec1,vec2);
add(out,out,vec2);
}
};
//////////////////////////////////////////////////////////////////////
// L1->L2 mrhs V-cycle (verbatim from the frozen example)
//////////////////////////////////////////////////////////////////////
template<class FineField, class MrhsCoarseVector, class FineSmoother>
class MrhsTwoLevelMG : public MrhsLinearFunction<FineField> {
public:
typedef MrhsCoarseVector CoarseVector;
LinearOperatorBase<FineField> &_FineOperator;
FineSmoother &_PostSmoother;
MultiRHSBlockProject<FineField> &_Projector;
LinearFunction<CoarseVector> &_CoarseSolve;
GridBase *_CoarseGrid, *_CoarseGridMrhs;
MrhsTwoLevelMG(LinearOperatorBase<FineField> &FineOp, FineSmoother &Post,
MultiRHSBlockProject<FineField> &Projector, LinearFunction<CoarseVector> &CoarseSolve,
GridBase *CoarseGrid, GridBase *CoarseGridMrhs)
: _FineOperator(FineOp),_PostSmoother(Post),_Projector(Projector),_CoarseSolve(CoarseSolve),
_CoarseGrid(CoarseGrid),_CoarseGridMrhs(CoarseGridMrhs){}
virtual void operator()(std::vector<FineField> &in, std::vector<FineField> &out){
int nrhs=in.size(); GridBase *fgrid=in[0].Grid(); double t;
std::vector<FineField> vec1(nrhs,fgrid),vec2(nrhs,fgrid);
for(int r=0;r<nrhs;r++) out[r]=in[r];
for(int r=0;r<nrhs;r++){ _FineOperator.Op(out[r],vec1[r]); sub(vec1[r],in[r],vec1[r]); }
std::vector<CoarseVector> Csrc_split(nrhs,_CoarseGrid), Csol_split(nrhs,_CoarseGrid);
CoarseVector CsrcMrhs(_CoarseGridMrhs), CsolMrhs(_CoarseGridMrhs);
t=-usecond();
_Projector.blockProject(vec1,Csrc_split);
for(int r=0;r<nrhs;r++) InsertSliceFast(Csrc_split[r],CsrcMrhs,r,0);
t+=usecond(); std::cout<<GridLogMessage<<"Mrhs project+pack took "<<t/1000.0<<"ms"<<std::endl;
t=-usecond(); CsolMrhs=Zero(); _CoarseSolve(CsrcMrhs,CsolMrhs); t+=usecond();
std::cout<<GridLogMessage<<"Mrhs coarse solve took "<<t/1000.0<<"ms ("<<t/1000.0/nrhs<<"ms/rhs)"<<std::endl;
t=-usecond();
for(int r=0;r<nrhs;r++) ExtractSliceFast(Csol_split[r],CsolMrhs,r,0);
_Projector.blockPromote(vec1,Csol_split);
for(int r=0;r<nrhs;r++) add(out[r],out[r],vec1[r]);
t+=usecond(); std::cout<<GridLogMessage<<"Mrhs unpack+promote took "<<t/1000.0<<"ms"<<std::endl;
for(int r=0;r<nrhs;r++){ _FineOperator.Op(out[r],vec1[r]); sub(vec1[r],in[r],vec1[r]); }
t=-usecond();
for(int r=0;r<nrhs;r++){ vec2[r]=Zero(); _PostSmoother(vec1[r],vec2[r]); add(out[r],out[r],vec2[r]); }
t+=usecond(); std::cout<<GridLogMessage<<"Mrhs post-smooth took "<<t/1000.0<<"ms ("<<t/1000.0/nrhs<<"ms/rhs)"<<std::endl;
}
};
int main (int argc, char ** argv)
{
Grid_init(&argc,&argv);
ParseEnvironment();
const int Ls=24; RealD M5=1.8, b=1.5, c=0.5;
const int nbasis=60; const int nrhs=Nrhs;
GRID_ASSERT(nrhs % vComplex::Nsimd() == 0);
std::vector<int> lat_size {48,48,48,96};
GridCartesian * UGrid = SpaceTimeGrid::makeFourDimGrid(lat_size, GridDefaultSimd(Nd,vComplex::Nsimd()),GridDefaultMpi());
GridRedBlackCartesian * UrbGrid = SpaceTimeGrid::makeFourDimRedBlackGrid(UGrid);
GridCartesian * FGrid = SpaceTimeGrid::makeFiveDimGrid(Ls,UGrid);
GridRedBlackCartesian * FrbGrid = SpaceTimeGrid::makeFiveDimRedBlackGrid(Ls,UGrid);
// Level 1 blocking (default 2^4)
Coordinate clatt = lat_size;
Coordinate Block({2,2,2,2});
if ( getenv("BLOCK") ){ GridCmdOptionIntVector(std::string(getenv("BLOCK")),Block); GRID_ASSERT(Block.size()==4); }
for(int d=0;d<4;d++){ GRID_ASSERT(lat_size[d]%Block[d]==0); clatt[d]=lat_size[d]/Block[d]; }
std::cout << GridLogMessage << "Block " << Block << " coarse lattice " << clatt << std::endl;
// Level 2 blocking: SUPERCOARSE default 8,4,3,6 -> CC [3,6,8,8], the dense floor.
Coordinate cclatt = clatt;
Coordinate Block2({8,4,3,6});
if ( getenv("BLOCK2") ){ GridCmdOptionIntVector(std::string(getenv("BLOCK2")),Block2); GRID_ASSERT(Block2.size()==4); }
for(int d=0;d<4;d++){ GRID_ASSERT(clatt[d]%Block2[d]==0); cclatt[d]=clatt[d]/Block2[d]; }
std::cout << GridLogMessage << "Block2 " << Block2 << " coarse-coarse lattice " << cclatt << std::endl;
GridCartesian *Coarse4d = SpaceTimeGrid::makeFourDimGrid(clatt, GridDefaultSimd(Nd,vComplex::Nsimd()),GridDefaultMpi());
GridCartesian *Coarse5d = SpaceTimeGrid::makeFiveDimGrid(1,Coarse4d);
GridCartesian *CoarseCoarse4d = SpaceTimeGrid::makeFourDimGrid(cclatt, GridDefaultSimd(Nd,vComplex::Nsimd()),GridDefaultMpi());
GridCartesian *CoarseCoarse5d = SpaceTimeGrid::makeFiveDimGrid(1,CoarseCoarse4d);
// 6D mrhs grids: rhs is dim 0, SIMD across rhs
Coordinate mpi=GridDefaultMpi();
Coordinate rhMpi ({1,1,mpi[0],mpi[1],mpi[2],mpi[3]});
Coordinate rhSimd({vComplex::Nsimd(),1,1,1,1,1});
Coordinate rhLatt ({nrhs,1,clatt[0], clatt[1], clatt[2], clatt[3]});
Coordinate rhLatt2({nrhs,1,cclatt[0],cclatt[1],cclatt[2],cclatt[3]});
GridCartesian *CoarseMrhs = new GridCartesian(rhLatt, rhSimd,rhMpi);
GridCartesian *CoarseCoarseMrhs = new GridCartesian(rhLatt2,rhSimd,rhMpi);
GridParallelRNG RNG5(FGrid); RNG5.SeedFixedIntegers({5,6,7,8});
LatticeGaugeField Umu(UGrid);
std::cout << GridLogMessage << "Reading gauge field" << std::endl;
FieldMetaData header;
std::string file("/ccs/home/poare/ckpoint_lat.1000");
NerscIO::readConfiguration(Umu,header,file);
MobiusFermionD Ddwf(Umu,*FGrid,*FrbGrid,*UGrid,*UrbGrid,mass,M5,b,c);
MobiusFermionD Dpv (Umu,*FGrid,*FrbGrid,*UGrid,*UrbGrid,1.0, M5,b,c);
typedef PVdagMLinearOperator<MobiusFermionD,LatticeFermionD> PVdagM_t;
typedef ShiftedPVdagMLinearOperator<MobiusFermionD,LatticeFermionD> ShiftedPVdagM_t;
// Level 1 tensor types
typedef GeneralCoarsenedMatrix<vSpinColourVector,vTComplex,nbasis> LittleDiracOperator;
typedef MultiGeneralCoarsenedMatrix<vSpinColourVector,vTComplex,nbasis> MrhsLittleDiracOperator;
typedef LittleDiracOperator::CoarseVector CoarseVector;
typedef Aggregation<vSpinColourVector,vTComplex,nbasis> Subspace;
// Level 2 tensor types (coarsening deepens the nest by one iScalar)
typedef CoarseVector::vector_object CoarseSiteObj;
typedef iScalar<vTComplex> vTTComplex;
typedef GeneralCoarsenedMatrix<CoarseSiteObj,vTTComplex,nbasis> LittleDiracOperatorL2;
typedef MultiGeneralCoarsenedMatrix<CoarseSiteObj,vTTComplex,nbasis> MrhsLittleDiracOperatorL2;
typedef LittleDiracOperatorL2::CoarseVector CoarseCoarseVector;
typedef Aggregation<CoarseSiteObj,vTTComplex,nbasis> SubspaceL2;
// The library dense bottom over the L2 coarse operator
typedef DenseCoarseMatrix<CoarseSiteObj,vTTComplex,nbasis> DenseCC_t;
PVdagM_t PVdagM(Ddwf,Dpv);
ShiftedPVdagM_t ShiftedPVdagM(FineSmootherShift,Ddwf,Dpv);
NextToNearestStencilGeometry5D geom (Coarse5d);
NextToNearestStencilGeometry5D geom2(CoarseCoarse5d);
//////////////////////////////////////////////////////////////////////
// Subspace: load RAW (no Orthogonalise!), or generate.
//////////////////////////////////////////////////////////////////////
std::string subspace_file = "/lustre/orion/phy157/proj-shared/phy157_dwf/paboyle/subspace_nb"
+ std::to_string(nbasis) + ".scidac";
if ( getenv("SUBSPACE_FILE") ) subspace_file = std::string(getenv("SUBSPACE_FILE"));
uint64_t file_exists=0;
if ( UGrid->IsBoss() ){ std::ifstream f(subspace_file); file_exists=f.good()?1:0; }
UGrid->GlobalSum(file_exists);
const int cb=0;
Subspace AggregatesGCR(Coarse5d,FGrid,cb);
if ( file_exists ){
std::cout << GridLogMessage << "*** Loading subspace from disk (kept RAW) ***" << std::endl;
loadSubspace(AggregatesGCR.subspace, subspace_file);
} else {
std::cout << GridLogMessage << "*** GCR subspace generation ***" << std::endl;
AggregatesGCR.CreateSubspaceGCR(RNG5,PVdagM,nbasis);
saveSubspace(AggregatesGCR.subspace, subspace_file);
}
// RAW copy of the fine null vectors BEFORE CoarsenOperator block-orthonormalises in place.
std::vector<LatticeFermionD> rawNull(nbasis,FGrid);
for(int k=0;k<nbasis;k++) rawNull[k]=AggregatesGCR.subspace[k];
//////////////////////////////////////////////////////////////////////
// Coarsen L1->L2 and L2->L3 with SINGLE-RHS machinery; import to mrhs via
// CopyMatrix. The L2 (coarse-coarse) single-RHS operator is HOISTED to
// main scope: DenseCoarseMatrix imports its stencil and uses its M for
// certificates, so it must stay alive for the whole run.
//////////////////////////////////////////////////////////////////////
MrhsLittleDiracOperator mrhsLittleDiracOpPV(geom, CoarseMrhs);
MrhsLittleDiracOperatorL2 mrhsLittleDiracOpL2(geom2, CoarseCoarseMrhs);
MultiRHSBlockProject<LatticeFermionD> MrhsProjector;
MultiRHSBlockProject<CoarseVector> MrhsProjectorL2;
LittleDiracOperatorL2 LittleDiracOpL2(geom2,Coarse5d,CoarseCoarse5d);
NonHermitianLinearOperator<LittleDiracOperatorL2,CoarseCoarseVector> LinOpCC5d(LittleDiracOpL2);
{
// --- L1->L2 single-RHS coarse operator (scoped: its padded _A is the memory peak) ---
LittleDiracOperator LittleDiracOpPV(geom,FGrid,Coarse5d);
LittleDiracOpPV.CoarsenOperator(PVdagM, AggregatesGCR); // orthonormalises AggregatesGCR.subspace in place
mrhsLittleDiracOpPV.CopyMatrix(LittleDiracOpPV);
MrhsProjector.Allocate(nbasis,FGrid,Coarse5d);
MrhsProjector.ImportBasis(AggregatesGCR.subspace);
NonHermitianLinearOperator<LittleDiracOperator,CoarseVector> LinOpCoarse(LittleDiracOpPV);
// --- psi_coarse = P^dag (RAW fine null) -> Galerkin images, NOT e_k ---
std::vector<CoarseVector> psi_coarse(nbasis,Coarse5d);
for(int k=0;k<nbasis;k++) AggregatesGCR.ProjectToSubspace(psi_coarse[k], rawNull[k]);
rawNull.clear(); rawNull.shrink_to_fit();
{
RealD s2=0.0;
for(int i=0;i<nbasis;i++) for(int j=0;j<nbasis;j++){
ComplexD sij=TensorRemove(innerProduct(psi_coarse[i],psi_coarse[j]));
ComplexD d=sij-(i==j?ComplexD(1.0):ComplexD(0.0)); s2+=real(d)*real(d)+imag(d)*imag(d);
}
std::cout<<GridLogMessage<<"GUARD: ||<psi_coarse|psi_coarse> - I||_F = "<<std::sqrt(s2)
<<" (~0.23 good; ~sqrt(N_coarse)="<<std::sqrt((double)Coarse5d->gSites())<<" = e_k leak)"<<std::endl;
}
// --- L2->L3 single-RHS coarsening ---
SubspaceL2 AggregatesL2(CoarseCoarse5d,Coarse5d,cb);
for(int k=0;k<nbasis;k++) AggregatesL2.subspace[k]=psi_coarse[k];
LittleDiracOpL2.CoarsenOperator(LinOpCoarse, AggregatesL2);
mrhsLittleDiracOpL2.CopyMatrix(LittleDiracOpL2);
MrhsProjectorL2.Allocate(nbasis,Coarse5d,CoarseCoarse5d);
MrhsProjectorL2.ImportBasis(AggregatesL2.subspace);
// --- guard psi_cc ---
{
std::vector<CoarseCoarseVector> psi_cc(nbasis,CoarseCoarse5d);
for(int k=0;k<nbasis;k++) AggregatesL2.ProjectToSubspace(psi_cc[k], psi_coarse[k]);
RealD s2=0.0;
for(int i=0;i<nbasis;i++) for(int j=0;j<nbasis;j++){
ComplexD sij=TensorRemove(innerProduct(psi_cc[i],psi_cc[j]));
ComplexD d=sij-(i==j?ComplexD(1.0):ComplexD(0.0)); s2+=real(d)*real(d)+imag(d)*imag(d);
}
std::cout<<GridLogMessage<<"GUARD: ||<psi_cc|psi_cc> - I||_F = "<<std::sqrt(s2)
<<" (~0.23 good; ~sqrt(N_cc)="<<std::sqrt((double)CoarseCoarse5d->gSites())<<" = e_k leak)"<<std::endl;
}
} // single-RHS FINE op + padded _A + AggregatesL2 + psi_coarse freed here
NonHermitianLinearOperator<MrhsLittleDiracOperator,CoarseVector> mrhsLinOpCoarse(mrhsLittleDiracOpPV);
NonHermitianLinearOperator<MrhsLittleDiracOperatorL2,CoarseCoarseVector> mrhsLinOpCC(mrhsLittleDiracOpL2);
//////////////////////////////////////////////////////////////////////
// DENSE coarse-coarse bottom: the LIBRARY class, constructed AFTER the
// fine coarsening frees its memory peak. Imports the stencil of the
// hoisted single-RHS LittleDiracOpL2 directly (no probing).
//////////////////////////////////////////////////////////////////////
std::unique_ptr<DenseCC_t> DenseCC;
std::unique_ptr<MrhsDenseCCSolve<DenseCC_t,CoarseCoarseVector>> MrhsDenseCC;
if (UseDenseCC) {
std::cout << GridLogMessage << "**********************************************" << std::endl;
std::cout << GridLogMessage << " Dense CC inverse setup (library DenseCoarseMatrix)" << std::endl;
std::cout << GridLogMessage << "**********************************************" << std::endl;
DenseCC.reset(new DenseCC_t(LittleDiracOpL2, CoarseCoarse5d));
MrhsDenseCC.reset(new MrhsDenseCCSolve<DenseCC_t,CoarseCoarseVector>(*DenseCC, CoarseCoarse5d, nrhs));
}
//////////////////////////////////////////////////////////////////////
// Solvers, innermost first.
//////////////////////////////////////////////////////////////////////
TrivialPrecon<CoarseVector> simpleC;
TrivialPrecon<CoarseCoarseVector> simpleCC;
TrivialPrecon<LatticeFermionD> simple_fine;
// L3 (coarse-coarse) iterative solve: PGCR on the 6D cc operator (DENSE_CC=0 branch)
PrecGeneralisedConjugateResidualNonHermitian<CoarseCoarseVector>
L3PGCR(L3Tol,L3MaxIt,mrhsLinOpCC,simpleCC,L3Nstep,L3Nstep);
L3PGCR.Level(3);
L3PGCR.Name("CCouter");
LinearFunction<CoarseCoarseVector> *ccSolve;
if (UseDenseCC) ccSolve = MrhsDenseCC.get();
else ccSolve = &L3PGCR;
// L2 coarse smoother: shifted 6D coarse op, fixed nstep
ShiftedLinearOperator<CoarseVector> ShiftedMrhsCoarse(CoarseSmootherShift, mrhsLinOpCoarse);
PrecGeneralisedConjugateResidualNonHermitian<CoarseVector>
CoarseSmootherGCR(0.01,1,ShiftedMrhsCoarse,simpleC,CoarseSmootherNstep,CoarseSmootherNstep);
CoarseSmootherGCR.Level(2);
CoarseSmootherGCR.Name("Csmoother");
CoarseSmootherGCR.SetZeroGuess(1); // caller zeroes vec2: skip r0 apply every L2 iteration
// L2->L3 V-cycle preconditioner (operates on 6D coarse field)
MrhsCoarseThreeLevelPrec<CoarseVector,CoarseCoarseVector>
L2to3Precon(mrhsLinOpCoarse, CoarseSmootherGCR, MrhsProjectorL2, *ccSolve,
Coarse5d, CoarseCoarse5d, CoarseCoarseMrhs, nrhs);
// L2 coarse solve: PGCR on 6D coarse op, preconditioned by the L2->L3 V-cycle
PrecGeneralisedConjugateResidualNonHermitian<CoarseVector>
L2PGCR(CoarseSolverTol, CoarseSolverOrder/16, mrhsLinOpCoarse, L2to3Precon, 16, 16);
L2PGCR.Level(2);
L2PGCR.Name("Couter");
L2PGCR.SetZeroGuess(1); // caller zeroes CsolMrhs; restarts still recompute r
// Fine smoother (per-rhs, looped in the L1->L2 V-cycle)
PrecGeneralisedConjugateResidualNonHermitian<LatticeFermionD>
SmootherGCR(0.0,1,ShiftedPVdagM,simple_fine,FineSmootherOrder,FineSmootherOrder);
SmootherGCR.Level(1);
SmootherGCR.Name("Fsmoother");
SmootherGCR.SetZeroGuess(1); // caller zeroes vec2[r]: saves 12 fine mults/outer
// L1->L2 V-cycle (fine); its coarse solve is the three-level L2PGCR
typedef PrecGeneralisedConjugateResidualNonHermitian<LatticeFermionD> FineSmoother_t;
MrhsTwoLevelMG<LatticeFermionD,CoarseVector,FineSmoother_t>
ThreeLevelPrecon(PVdagM, SmootherGCR, MrhsProjector, L2PGCR, Coarse5d, CoarseMrhs);
// Outer mrhs solve
MrhsPGCRNonHermitian<LatticeFermionD>
L1PGCR(OuterTol,1000,PVdagM,ThreeLevelPrecon,OuterMmax,OuterNstep);
L1PGCR.Level(1);
L1PGCR.Name("Fouter");
L1PGCR.SetZeroGuess(1); // sol[r]=Zero() below; restarts recompute r as always
//////////////////////////////////////////////////////////////////////
// Sources and solve
//////////////////////////////////////////////////////////////////////
std::vector<LatticeFermionD> src(nrhs,FGrid), sol(nrhs,FGrid);
for(int r=0;r<nrhs;r++){ gaussian(RNG5,src[r]); sol[r]=Zero(); }
std::cout << GridLogMessage << "**********************************************" << std::endl;
std::cout << GridLogMessage << " MultiRHS THREE-level solve (DenseCoarseMatrix bottom): " << nrhs << " RHS " << std::endl;
std::cout << GridLogMessage << "**********************************************" << std::endl;
GridStopWatch w; w.Start();
L1PGCR(src,sol);
w.Stop();
std::cout << GridLogMessage << "MultiRHS 3-level dense solve total " << w.Elapsed()
<< " (per RHS: " << w.useconds()/1.0e6/nrhs << " s)" << std::endl;
{ LatticeFermionD Ax(FGrid); RealD worst=0.0;
for(int r=0;r<nrhs;r++){ PVdagM.Op(sol[r],Ax); Ax=Ax-src[r];
RealD rn=std::sqrt(norm2(Ax)/norm2(src[r]));
std::cout << GridLogMessage << "FINAL: rhs["<<r<<"] true residual = " << rn << std::endl;
worst=std::max(worst,rn); }
std::cout << GridLogMessage << "FINAL: worst-case residual = " << worst << std::endl;
}
std::cout << GridLogMessage << "Done" << std::endl;
Grid_finalize();
return 0;
}
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/*************************************************************************************
Grid physics library, www.github.com/paboyle/Grid
Source file: ./tests/debug/Test_batched_blas.cc
Copyright (C) 2026
Author: Peter Boyle <pboyle@bnl.gov>
This program is free software; you can redistribute it and/or modify
it under the terms of the GNU General Public License as published by
the Free Software Foundation; either version 2 of the License, or
(at your option) any later version.
This program is distributed in the hope that it will be useful,
but WITHOUT ANY WARRANTY; without even the implied warranty of
MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
GNU General Public License for more details.
You should have received a copy of the GNU General Public License along
with this program; if not, write to the Free Software Foundation, Inc.,
51 Franklin Street, Fifth Floor, Boston, MA 02110-1301 USA.
See the full license in the file "LICENSE" in the top level distribution directory
*************************************************************************************/
/* END LEGAL */
//
// Unit tests for the blas-layer dense primitives:
//
// T1 : GridBLASInverse::inverseBatched (ComplexF and ComplexD) --
// || A A^{-1} - I ||_max over a random well-conditioned batch.
// On a CPU build this exercises the Eigen reference (the semantic
// oracle); the SAME binary exercises rocSOLVER/cuBLAS/oneMKL on a
// device build.
// T2 : explicit-leading-dimension gemmBatched == SOFTWARE SPLIT-K in
// miniature. Y = op(A,T).X computed (a) in one compact batch=1 call
// and (b) as NK K-chunks by POINTER OFFSET with lda = full K, partials
// reduced on the host. (a)==(b) validates the strided overload AND
// the production dense-slab apply pattern (arXiv:2409.03904 fig 11).
//
// Hard asserts throughout: regression gate for Grid/algorithms/blas.
//
#include <Grid/Grid.h>
#include <Grid/algorithms/blas/BatchedInverse.h>
#include <random>
using namespace std;
using namespace Grid;
int main (int argc, char ** argv)
{
Grid_init(&argc,&argv);
GridBLAS blas;
GridBLASInverse inverse;
std::mt19937 rng(12345);
std::uniform_real_distribution<double> dist(-1.0,1.0);
////////////////////////////////////////////////////////////////
// T1a : batched inversion, ComplexF
////////////////////////////////////////////////////////////////
{
const int64_t N = 64;
const int batch = 4;
const uint64_t elems = (uint64_t)batch*N*N;
// Random diagonally-dominant batch: A = N*I + R, |R_ij| <= 1
std::vector<ComplexF> Ahost(elems);
for(uint64_t i=0;i<elems;i++) Ahost[i] = ComplexF(dist(rng),dist(rng));
for(int b=0;b<batch;b++)
for(int64_t d=0;d<N;d++)
Ahost[(uint64_t)b*N*N + d*N + d] += ComplexF((RealF)N,0.0);
deviceVector<ComplexF> Adev(elems); // gets inverted in place
deviceVector<ComplexF> Aorig(elems); // untouched copy for the residual
deviceVector<ComplexF> Cdev(elems);
acceleratorCopyToDevice(&Ahost[0],&Adev[0], elems*sizeof(ComplexF));
acceleratorCopyToDevice(&Ahost[0],&Aorig[0],elems*sizeof(ComplexF));
deviceVector<ComplexF*> Ap(batch);
deviceVector<ComplexF*> Op(batch);
deviceVector<ComplexF*> Cp(batch);
std::vector<ComplexF*> ptr_h(batch);
for(int b=0;b<batch;b++) ptr_h[b] = &Adev[(uint64_t)b*N*N];
acceleratorCopyToDevice(&ptr_h[0],&Ap[0],batch*sizeof(ComplexF*));
for(int b=0;b<batch;b++) ptr_h[b] = &Aorig[(uint64_t)b*N*N];
acceleratorCopyToDevice(&ptr_h[0],&Op[0],batch*sizeof(ComplexF*));
for(int b=0;b<batch;b++) ptr_h[b] = &Cdev[(uint64_t)b*N*N];
acceleratorCopyToDevice(&ptr_h[0],&Cp[0],batch*sizeof(ComplexF*));
inverse.inverseBatched(N,Ap); // A <- A^{-1}
ComplexF one (1.0,0.0);
ComplexF zero(0.0,0.0);
blas.gemmBatched(GridBLAS_OP_N,GridBLAS_OP_N,
(int)N,(int)N,(int)N,
one, Op, Ap, zero, Cp); // C = A A^{-1}
blas.synchronise();
std::vector<ComplexF> Chost(elems);
acceleratorCopyFromDevice(&Cdev[0],&Chost[0],elems*sizeof(ComplexF));
double maxdev = 0.0;
for(int b=0;b<batch;b++)
for(int64_t j=0;j<N;j++)
for(int64_t i=0;i<N;i++){
ComplexF expect = (i==j) ? ComplexF(1.0,0.0) : ComplexF(0.0,0.0);
ComplexF got = Chost[(uint64_t)b*N*N + j*N + i];
maxdev = std::max(maxdev,(double)abs(got-expect));
}
std::cout << GridLogMessage << "T1a inverseBatched ComplexF ||A Ainv - I||_max = "
<< maxdev << ( maxdev < 1.0e-4 ? " PASS" : " FAIL" ) << std::endl;
GRID_ASSERT(maxdev < 1.0e-4);
}
////////////////////////////////////////////////////////////////
// T1b : batched inversion, ComplexD
////////////////////////////////////////////////////////////////
{
const int64_t N = 48;
const int batch = 3;
const uint64_t elems = (uint64_t)batch*N*N;
std::vector<ComplexD> Ahost(elems);
for(uint64_t i=0;i<elems;i++) Ahost[i] = ComplexD(dist(rng),dist(rng));
for(int b=0;b<batch;b++)
for(int64_t d=0;d<N;d++)
Ahost[(uint64_t)b*N*N + d*N + d] += ComplexD((RealD)N,0.0);
deviceVector<ComplexD> Adev(elems);
deviceVector<ComplexD> Aorig(elems);
deviceVector<ComplexD> Cdev(elems);
acceleratorCopyToDevice(&Ahost[0],&Adev[0], elems*sizeof(ComplexD));
acceleratorCopyToDevice(&Ahost[0],&Aorig[0],elems*sizeof(ComplexD));
deviceVector<ComplexD*> Ap(batch);
deviceVector<ComplexD*> Op(batch);
deviceVector<ComplexD*> Cp(batch);
std::vector<ComplexD*> ptr_h(batch);
for(int b=0;b<batch;b++) ptr_h[b] = &Adev[(uint64_t)b*N*N];
acceleratorCopyToDevice(&ptr_h[0],&Ap[0],batch*sizeof(ComplexD*));
for(int b=0;b<batch;b++) ptr_h[b] = &Aorig[(uint64_t)b*N*N];
acceleratorCopyToDevice(&ptr_h[0],&Op[0],batch*sizeof(ComplexD*));
for(int b=0;b<batch;b++) ptr_h[b] = &Cdev[(uint64_t)b*N*N];
acceleratorCopyToDevice(&ptr_h[0],&Cp[0],batch*sizeof(ComplexD*));
inverse.inverseBatched(N,Ap);
ComplexD one (1.0,0.0);
ComplexD zero(0.0,0.0);
blas.gemmBatched(GridBLAS_OP_N,GridBLAS_OP_N,
(int)N,(int)N,(int)N,
one, Op, Ap, zero, Cp);
blas.synchronise();
std::vector<ComplexD> Chost(elems);
acceleratorCopyFromDevice(&Cdev[0],&Chost[0],elems*sizeof(ComplexD));
double maxdev = 0.0;
for(int b=0;b<batch;b++)
for(int64_t j=0;j<N;j++)
for(int64_t i=0;i<N;i++){
ComplexD expect = (i==j) ? ComplexD(1.0,0.0) : ComplexD(0.0,0.0);
ComplexD got = Chost[(uint64_t)b*N*N + j*N + i];
maxdev = std::max(maxdev,(double)abs(got-expect));
}
std::cout << GridLogMessage << "T1b inverseBatched ComplexD ||A Ainv - I||_max = "
<< maxdev << ( maxdev < 1.0e-10 ? " PASS" : " FAIL" ) << std::endl;
GRID_ASSERT(maxdev < 1.0e-10);
}
////////////////////////////////////////////////////////////////
// T2 : explicit-ld gemmBatched == software split-K miniature.
// Slab layout as in the dense coarse-coarse apply: A is K x nrows
// column major (lda=K); Y = op(A,T).X with X K x nrhs (ldb=K).
////////////////////////////////////////////////////////////////
{
const int nrows = 8;
const int nrhs = 4;
const int K = 256;
const int NK = 8; // split-K chunks
const int Kc = K/NK;
std::vector<ComplexF> Ahost((uint64_t)K*nrows);
std::vector<ComplexF> Xhost((uint64_t)K*nrhs);
for(auto &z : Ahost) z = ComplexF(dist(rng),dist(rng));
for(auto &z : Xhost) z = ComplexF(dist(rng),dist(rng));
deviceVector<ComplexF> Adev(Ahost.size());
deviceVector<ComplexF> Xdev(Xhost.size());
deviceVector<ComplexF> Yref((uint64_t)nrows*nrhs);
deviceVector<ComplexF> Ypart((uint64_t)NK*nrows*nrhs);
acceleratorCopyToDevice(&Ahost[0],&Adev[0],Ahost.size()*sizeof(ComplexF));
acceleratorCopyToDevice(&Xhost[0],&Xdev[0],Xhost.size()*sizeof(ComplexF));
ComplexF one (1.0,0.0);
ComplexF zero(0.0,0.0);
// (a) reference: one compact batch=1 call (compact lda == K for OP_T)
{
deviceVector<ComplexF*> Ap(1), Xp(1), Yp(1);
std::vector<ComplexF*> h(1);
h[0]=&Adev[0]; acceleratorCopyToDevice(&h[0],&Ap[0],sizeof(ComplexF*));
h[0]=&Xdev[0]; acceleratorCopyToDevice(&h[0],&Xp[0],sizeof(ComplexF*));
h[0]=&Yref[0]; acceleratorCopyToDevice(&h[0],&Yp[0],sizeof(ComplexF*));
blas.gemmBatched(GridBLAS_OP_T,GridBLAS_OP_N,
nrows,nrhs,K,
one, Ap, Xp, zero, Yp);
blas.synchronise();
}
// (b) split-K: NK chunk-pointers into the SAME allocations, lda/ldb = K
{
deviceVector<ComplexF*> Ap(NK), Xp(NK), Yp(NK);
std::vector<ComplexF*> h(NK);
for(int j=0;j<NK;j++) h[j] = &Adev[(uint64_t)j*Kc]; // K-offset slice
acceleratorCopyToDevice(&h[0],&Ap[0],NK*sizeof(ComplexF*));
for(int j=0;j<NK;j++) h[j] = &Xdev[(uint64_t)j*Kc];
acceleratorCopyToDevice(&h[0],&Xp[0],NK*sizeof(ComplexF*));
for(int j=0;j<NK;j++) h[j] = &Ypart[(uint64_t)j*nrows*nrhs];
acceleratorCopyToDevice(&h[0],&Yp[0],NK*sizeof(ComplexF*));
blas.gemmBatched(GridBLAS_OP_T,GridBLAS_OP_N,
nrows,nrhs,Kc,
one, Ap, /*lda*/ K,
Xp, /*ldb*/ K,
zero,Yp, /*ldc*/ nrows);
blas.synchronise();
}
std::vector<ComplexF> Yref_h((uint64_t)nrows*nrhs);
std::vector<ComplexF> Ypart_h((uint64_t)NK*nrows*nrhs);
acceleratorCopyFromDevice(&Yref[0], &Yref_h[0], Yref_h.size()*sizeof(ComplexF));
acceleratorCopyFromDevice(&Ypart[0],&Ypart_h[0],Ypart_h.size()*sizeof(ComplexF));
double maxdev = 0.0;
double maxval = 0.0;
for(int i=0;i<nrows*nrhs;i++){
ComplexF sum(0.0,0.0);
for(int j=0;j<NK;j++) sum = sum + Ypart_h[(uint64_t)j*nrows*nrhs + i];
maxdev = std::max(maxdev,(double)abs(sum-Yref_h[i]));
maxval = std::max(maxval,(double)abs(Yref_h[i]));
}
double rel = maxdev/maxval;
std::cout << GridLogMessage << "T2 split-K strided gemmBatched max rel dev vs compact = "
<< rel << ( rel < 1.0e-4 ? " PASS" : " FAIL" ) << std::endl;
GRID_ASSERT(rel < 1.0e-4);
}
std::cout << GridLogMessage << "All batched-blas tests PASSED" << std::endl;
Grid_finalize();
}
+279
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/*************************************************************************************
Grid physics library, www.github.com/paboyle/Grid
Source file: ./tests/forces/Test_dwf_ratio_4dpf_force.cc
Copyright (C) 2026
Author: Peter Boyle <pboyle@bnl.gov>
This program is free software; you can redistribute it and/or modify
it under the terms of the GNU General Public License as published by
the Free Software Foundation; either version 2 of the License, or
(at your option) any later version.
This program is distributed in the hope that it will be useful,
but WITHOUT ANY WARRANTY; without even the implied warranty of
MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
GNU General Public License for more details.
You should have received a copy of the GNU General Public License along
with this program; if not, write to the Free Software Foundation, Inc.,
51 Franklin Street, Fifth Floor, Boston, MA 02110-1301 USA.
See the full license in the file "LICENSE" in the top level distribution directory
*************************************************************************************/
/* END LEGAL */
//
// Validation of TwoFlavourRatio4DPseudoFermionAction (non-EO, LinearFunction
// solver slots). Three tests, run for BOTH wall conventions:
//
// T1 HeatbathIdentityTest : refresh then S; PASS iff S == 0.5*|eta4|^2 to
// solver tolerance. This adjudicates the 4D effective-operator
// composition identity [P M^-1 V Pdag][P V^-1 M Pdag] = 1 for the chosen
// (P,Pdag) wall pair. NO PREDICTION is made about which convention
// passes -- that is what the test decides.
// T2 ForceTest (idiom from Test_double_ratio.cc) : midpoint-derivative
// check of deriv against S. Should PASS for BOTH conventions (S and
// deriv use the same literal-adjoint pair by construction).
// T3 Trivial-ratio control (V == M) : T1 with NumOp = DenOp. The solve
// cancels against the multiply, so S = 0.5|eta4|^2 requires only
// P Pdag = 1_4d. Should PASS for BOTH conventions; isolates plumbing
// from the composition identity.
//
// Solvers here are plain CG on the normal equations (CGNR), tolerance 1e-12,
// so every defect above ~1e-10 is structural, not solver noise. Run small,
// e.g.: ./Test_dwf_ratio_4dpf_force --grid 8.8.8.8
//
#include <Grid/Grid.h>
#include <Grid/qcd/action/pseudofermion/TwoFlavourRatio4DPseudoFermion.h>
using namespace std;
using namespace Grid;
////////////////////////////////////////////////////////////////////
// LinearFunction wrappers: direct M^-1 and M^-dag via CG on the
// normal equations. These stand in for the MG-GCR stack in this
// test; the action class sees only LinearFunction.
////////////////////////////////////////////////////////////////////
template<class Matrix,class Field>
class CGNRLinearFunction : public LinearFunction<Field> { // out = M^-1 in
public:
using LinearFunction<Field>::operator();
Matrix &_Mat; RealD tol; Integer maxit;
CGNRLinearFunction(Matrix &Mat,RealD _tol,Integer _maxit) : _Mat(Mat), tol(_tol), maxit(_maxit) {};
void operator()(const Field &in, Field &out) {
MdagMLinearOperator<Matrix,Field> MdagM(_Mat);
Field src(in.Grid());
_Mat.Mdag(in,src); // src = Mdag in
ConjugateGradient<Field> CG(tol,maxit);
out = Zero();
CG(MdagM,src,out); // out = (MdagM)^-1 Mdag in = M^-1 in
}
};
template<class Matrix,class Field>
class CGNRDagLinearFunction : public LinearFunction<Field> { // out = M^-dag in
public:
using LinearFunction<Field>::operator();
Matrix &_Mat; RealD tol; Integer maxit;
CGNRDagLinearFunction(Matrix &Mat,RealD _tol,Integer _maxit) : _Mat(Mat), tol(_tol), maxit(_maxit) {};
void operator()(const Field &in, Field &out) {
MdagMLinearOperator<Matrix,Field> MdagM(_Mat);
Field tmp(in.Grid());
tmp = Zero();
ConjugateGradient<Field> CG(tol,maxit);
CG(MdagM,in,tmp); // tmp = (MdagM)^-1 in
_Mat.M(tmp,out); // out = M (MdagM)^-1 in = M^-dag in
}
};
////////////////////////////////////////////////////////////////////
// T1 / T3 : heatbath composition-identity test.
// Twin-seeded RNG reproduces the eta4 drawn inside refresh.
////////////////////////////////////////////////////////////////////
template<class Impl>
RealD HeatbathIdentityTest(TwoFlavourRatio4DPseudoFermionAction<Impl> &action,
LatticeGaugeField &U,
GridCartesian *UGrid,
const std::string &tag)
{
typedef typename Impl::FermionField FermionField;
std::vector<int> seeds({9,11,13,17});
GridSerialRNG sRNG; sRNG.SeedFixedIntegers(seeds);
GridParallelRNG RNG4(UGrid); RNG4.SeedFixedIntegers(seeds);
GridParallelRNG RNG4check(UGrid); RNG4check.SeedFixedIntegers(seeds);
FermionField eta4check(UGrid);
gaussian(RNG4check,eta4check); // identical to the draw inside refresh
action.refresh(U,sRNG,RNG4);
RealD S = action.S(U);
RealD Sexpect = 0.5*norm2(eta4check);
RealD defect = std::abs(S-Sexpect)/Sexpect;
std::cout << GridLogMessage << "=========================================================" << std::endl;
std::cout << GridLogMessage << " HeatbathIdentityTest ["<<tag<<"]" << std::endl;
std::cout << GridLogMessage << " S = " << S << std::endl;
std::cout << GridLogMessage << " 0.5|eta4|^2 = " << Sexpect << std::endl;
std::cout << GridLogMessage << " relative defect = " << defect
<< ( defect < 1.0e-8 ? " PASS" : " FAIL" ) << std::endl;
std::cout << GridLogMessage << "=========================================================" << std::endl;
return defect;
}
////////////////////////////////////////////////////////////////////
// T2 : ForceTest idiom from Test_double_ratio.cc (midpoint derivative)
////////////////////////////////////////////////////////////////////
template<class Gimpl>
void ForceTest(Action<LatticeGaugeField> &action,LatticeGaugeField & U,MomentumFilterBase<LatticeGaugeField> &Filter)
{
GridBase *UGrid = U.Grid();
std::vector<int> seeds({1,2,3,5});
GridSerialRNG sRNG; sRNG.SeedFixedIntegers(seeds);
GridParallelRNG RNG4(UGrid); RNG4.SeedFixedIntegers(seeds);
LatticeColourMatrix Pmu(UGrid);
LatticeGaugeField P(UGrid);
LatticeGaugeField UdSdU(UGrid);
std::cout << GridLogMessage << "*********************************************************"<<std::endl;
std::cout << GridLogMessage << " Force test for "<<action.action_name()<<std::endl;
std::cout << GridLogMessage << "*********************************************************"<<std::endl;
RealD eps=0.005;
Gimpl::generate_momenta(P,sRNG,RNG4);
Filter.applyFilter(P);
action.refresh(U,sRNG,RNG4);
RealD S1 = action.S(U);
Gimpl::update_field(P,U,eps);
action.deriv(U,UdSdU);
UdSdU = Ta(UdSdU);
Filter.applyFilter(UdSdU);
DumpSliceNorm("Force",UdSdU,Nd-1);
Gimpl::update_field(P,U,eps);
RealD S2 = action.S(U);
// Use the derivative
LatticeComplex dS(UGrid); dS = Zero();
for(int mu=0;mu<Nd;mu++){
auto UdSdUmu = PeekIndex<LorentzIndex>(UdSdU,mu);
Pmu= PeekIndex<LorentzIndex>(P,mu);
dS = dS - trace(Pmu*UdSdUmu)*eps*2.0*2.0;
}
ComplexD dSpred = sum(dS);
RealD diff = S2-S1-dSpred.real();
std::cout<< GridLogMessage << "+++++++++++++++++++++++++++++++++++++++++++++++++++++++++"<<std::endl;
std::cout<< GridLogMessage << "S1 : "<< S1 <<std::endl;
std::cout<< GridLogMessage << "S2 : "<< S2 <<std::endl;
std::cout<< GridLogMessage << "dS : "<< S2-S1 <<std::endl;
std::cout<< GridLogMessage << "dSpred : "<< dSpred.real() <<std::endl;
std::cout<< GridLogMessage << "diff : "<< diff<<std::endl;
std::cout<< GridLogMessage << "diff/dS : "<< diff/(S2-S1)<<std::endl;
std::cout<< GridLogMessage << "*********************************************************"<<std::endl;
// GRID_ASSERT(diff<1.0);
std::cout<< GridLogMessage << "Done" <<std::endl;
std::cout << GridLogMessage << "*********************************************************"<<std::endl;
}
int main (int argc, char ** argv)
{
Grid_init(&argc,&argv);
std::cout << std::setprecision(14);
const int Ls=8;
GridCartesian * UGrid = SpaceTimeGrid::makeFourDimGrid(GridDefaultLatt(), GridDefaultSimd(Nd,vComplex::Nsimd()),GridDefaultMpi());
GridRedBlackCartesian * UrbGrid = SpaceTimeGrid::makeFourDimRedBlackGrid(UGrid);
GridCartesian * FGrid = SpaceTimeGrid::makeFiveDimGrid(Ls,UGrid);
GridRedBlackCartesian * FrbGrid = SpaceTimeGrid::makeFiveDimRedBlackGrid(Ls,UGrid);
std::vector<int> seeds4({1,2,3,4});
GridParallelRNG RNG4(UGrid); RNG4.SeedFixedIntegers(seeds4);
LatticeGaugeField U(UGrid);
SU<Nc>::HotConfiguration(RNG4,U);
////////////////////////////////////////////////////////////////
// Operators: Mobius, campaign-like b,c; heavyish masses so CGNR
// is fast and well-conditioned even on a hot configuration.
////////////////////////////////////////////////////////////////
RealD mden = 0.2;
RealD mnum = 0.5;
RealD M5 = 1.8;
RealD b = 1.5;
RealD c = 0.5;
WilsonImplParams p;
p.boundary_phases[0] = 1.0;
p.boundary_phases[1] = 1.0;
p.boundary_phases[2] = 1.0;
p.boundary_phases[3] = -1.0;
MobiusFermionD DenOp(U,*FGrid,*FrbGrid,*UGrid,*UrbGrid,mden,M5,b,c,p);
MobiusFermionD NumOp(U,*FGrid,*FrbGrid,*UGrid,*UrbGrid,mnum,M5,b,c,p);
RealD tol = 1.0e-12;
Integer maxit = 20000;
typedef WilsonImplD::FermionField FermionField;
CGNRLinearFunction<MobiusFermionD,FermionField> MinvSolver (DenOp,tol,maxit);
CGNRDagLinearFunction<MobiusFermionD,FermionField> MdagInvSolver(DenOp,tol,maxit);
CGNRLinearFunction<MobiusFermionD,FermionField> VinvSolver (NumOp,tol,maxit);
////////////////////////////////////////////////////////////////
// Actions: both wall conventions, plus the V==M trivial control
////////////////////////////////////////////////////////////////
TwoFlavourRatio4DPseudoFermionAction<WilsonImplD> ActSol(NumOp,DenOp,MinvSolver,MdagInvSolver,MinvSolver,VinvSolver,1);
TwoFlavourRatio4DPseudoFermionAction<WilsonImplD> ActSrc(NumOp,DenOp,MinvSolver,MdagInvSolver,MinvSolver,VinvSolver,0);
TwoFlavourRatio4DPseudoFermionAction<WilsonImplD> ActTrivSol(DenOp,DenOp,MinvSolver,MdagInvSolver,MinvSolver,MinvSolver,1);
TwoFlavourRatio4DPseudoFermionAction<WilsonImplD> ActTrivSrc(DenOp,DenOp,MinvSolver,MdagInvSolver,MinvSolver,MinvSolver,0);
////////////////////////////////////////////////////////////////
// T3 controls first (must both pass; isolates plumbing)
////////////////////////////////////////////////////////////////
RealD d3s = HeatbathIdentityTest(ActTrivSol,U,UGrid,"T3 trivial V==M, solution walls");
RealD d3q = HeatbathIdentityTest(ActTrivSrc,U,UGrid,"T3 trivial V==M, source walls");
////////////////////////////////////////////////////////////////
// T1 : the composition-identity adjudication
////////////////////////////////////////////////////////////////
RealD d1s = HeatbathIdentityTest(ActSol,U,UGrid,"T1 ratio, solution walls");
RealD d1q = HeatbathIdentityTest(ActSrc,U,UGrid,"T1 ratio, source walls");
////////////////////////////////////////////////////////////////
// T2 : force consistency (expected PASS for both conventions)
////////////////////////////////////////////////////////////////
MomentumFilterNone<LatticeGaugeField> FilterNone;
ForceTest<GimplTypesR>(ActSol,U,FilterNone);
ForceTest<GimplTypesR>(ActSrc,U,FilterNone);
////////////////////////////////////////////////////////////////
// Summary
////////////////////////////////////////////////////////////////
std::cout << GridLogMessage << "=========================================================" << std::endl;
std::cout << GridLogMessage << " SUMMARY (relative heatbath defects)" << std::endl;
std::cout << GridLogMessage << " T3 trivial solution walls : " << d3s << std::endl;
std::cout << GridLogMessage << " T3 trivial source walls : " << d3q << std::endl;
std::cout << GridLogMessage << " T1 ratio solution walls : " << d1s << std::endl;
std::cout << GridLogMessage << " T1 ratio source walls : " << d1q << std::endl;
std::cout << GridLogMessage << " T3 must pass for both; T1 selects the wall convention." << std::endl;
std::cout << GridLogMessage << "=========================================================" << std::endl;
GRID_ASSERT(d3s < 1.0e-8);
GRID_ASSERT(d3q < 1.0e-8);
Grid_finalize();
}
+341
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@@ -0,0 +1,341 @@
/*************************************************************************************
Grid physics library, www.github.com/paboyle/Grid
Source file: ./tests/forces/Test_dwf_ratio_leftprec.cc
Copyright (C) 2026
Author: Peter Boyle <pboyle@bnl.gov>
This program is free software; you can redistribute it and/or modify
it under the terms of the GNU General Public License as published by
the Free Software Foundation; either version 2 of the License, or
(at your option) any later version.
This program is distributed in the hope that it will be useful,
but WITHOUT ANY WARRANTY; without even the implied warranty of
MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
GNU General Public License for more details.
You should have received a copy of the GNU General Public License along
with this program; if not, write to the Free Software Foundation, Inc.,
51 Franklin Street, Fifth Floor, Boston, MA 02110-1301 USA.
See the full license in the file "LICENSE" in the top level distribution directory
*************************************************************************************/
/* END LEGAL */
//
// Correctness of TwoFlavourRatioLeftPrecPseudoFermionAction against the
// decades-proven TwoFlavourRatioPseudoFermionAction. Both classes compute
// the SAME action S = phi^dag V (MdagM)^-1 Vdag phi through different solve
// chains (normal-equations vs left-preconditioned F = Vdag M), so with
// twin-seeded refreshes and 1e-12 solvers they must agree to solver
// tolerance. Tests:
//
// E0a/E0b : heatbath identity, S == 0.5|eta|^2 after RNG refresh, for
// BOTH classes (E0a also validates the twin-eta capture).
// E1 : S_classic == S_leftprec (relative, ~1e-8)
// E2 : deriv_classic == deriv_leftprec (pointwise field norm, ~1e-8)
// F1 : ForceTest (Test_double_ratio.cc idiom) on the LeftPrec class.
//
// All asserts are hard: this is the regression gate for the new class.
// Run small, e.g.: ./Test_dwf_ratio_leftprec --grid 8.8.8.8
//
#include <Grid/Grid.h>
#include <Grid/qcd/action/pseudofermion/TwoFlavourRatioLeftPrec.h>
using namespace std;
using namespace Grid;
////////////////////////////////////////////////////////////////////
// Minimal LinearOperator for the composite F = Vdag M, exposing the
// Hermitian normal operator FdagF for CG. Stencil entries assert.
////////////////////////////////////////////////////////////////////
template<class Impl>
class VdagMNormalOperator : public LinearOperatorBase<typename Impl::FermionField> {
public:
typedef typename Impl::FermionField Field;
FermionOperator<Impl> &VOp;
FermionOperator<Impl> &MOp;
VdagMNormalOperator(FermionOperator<Impl> &V,FermionOperator<Impl> &M) : VOp(V), MOp(M) {};
void Fapply(const Field &in, Field &out) { // out = Vdag M in
Field tmp(in.Grid());
MOp.M(in,tmp);
VOp.Mdag(tmp,out);
}
void FdagApply(const Field &in, Field &out) { // out = Mdag V in
Field tmp(in.Grid());
VOp.M(in,tmp);
MOp.Mdag(tmp,out);
}
virtual void Op (const Field &in, Field &out) { Fapply(in,out); }
virtual void AdjOp (const Field &in, Field &out) { FdagApply(in,out); }
virtual void HermOp (const Field &in, Field &out) {
Field tmp(in.Grid());
Fapply(in,tmp);
FdagApply(tmp,out);
}
virtual void HermOpAndNorm(const Field &in, Field &out,RealD &n1,RealD &n2) {
HermOp(in,out);
ComplexD dot = innerProduct(in,out);
n1 = real(dot);
n2 = norm2(out);
}
virtual void OpDiag (const Field &in, Field &out) { GRID_ASSERT(0); }
virtual void OpDir (const Field &in, Field &out,int dir,int disp) { GRID_ASSERT(0); }
virtual void OpDirAll(const Field &in, std::vector<Field> &out) { GRID_ASSERT(0); }
};
////////////////////////////////////////////////////////////////////
// F-contract LinearFunctions for the test, both via CG on FdagF:
// forward : F x = b ==> x = (FdagF)^-1 Fdag b
// adjoint : Fdag z = b ==> z = F (FdagF)^-1 b
////////////////////////////////////////////////////////////////////
template<class Impl>
class ForwardFSolve : public LinearFunction<typename Impl::FermionField> {
public:
typedef typename Impl::FermionField Field;
using LinearFunction<Field>::operator();
VdagMNormalOperator<Impl> &FdagF; RealD tol; Integer maxit;
ForwardFSolve(VdagMNormalOperator<Impl> &Op,RealD _tol,Integer _maxit) : FdagF(Op), tol(_tol), maxit(_maxit) {};
void operator()(const Field &in, Field &out) {
Field src(in.Grid());
FdagF.FdagApply(in,src);
ConjugateGradient<Field> CG(tol,maxit);
out = Zero();
CG(FdagF,src,out);
}
};
template<class Impl>
class AdjointFSolve : public LinearFunction<typename Impl::FermionField> {
public:
typedef typename Impl::FermionField Field;
using LinearFunction<Field>::operator();
VdagMNormalOperator<Impl> &FdagF; RealD tol; Integer maxit;
AdjointFSolve(VdagMNormalOperator<Impl> &Op,RealD _tol,Integer _maxit) : FdagF(Op), tol(_tol), maxit(_maxit) {};
void operator()(const Field &in, Field &out) {
Field y(in.Grid());
y = Zero();
ConjugateGradient<Field> CG(tol,maxit);
CG(FdagF,in,y);
FdagF.Fapply(y,out);
}
};
template<class Matrix,class Field>
class NormalEqSolve : public LinearFunction<Field> { // out = (MdagM)^-1 in
public:
using LinearFunction<Field>::operator();
Matrix &_Mat; RealD tol; Integer maxit;
NormalEqSolve(Matrix &Mat,RealD _tol,Integer _maxit) : _Mat(Mat), tol(_tol), maxit(_maxit) {};
void operator()(const Field &in, Field &out) {
MdagMLinearOperator<Matrix,Field> MdagM(_Mat);
ConjugateGradient<Field> CG(tol,maxit);
out = Zero();
CG(MdagM,in,out);
}
};
////////////////////////////////////////////////////////////////////
// ForceTest idiom from Test_double_ratio.cc (midpoint derivative)
////////////////////////////////////////////////////////////////////
template<class Gimpl>
void ForceTest(Action<LatticeGaugeField> &action,LatticeGaugeField & U,MomentumFilterBase<LatticeGaugeField> &Filter)
{
GridBase *UGrid = U.Grid();
std::vector<int> seeds({1,2,3,5});
GridSerialRNG sRNG; sRNG.SeedFixedIntegers(seeds);
GridParallelRNG RNG4(UGrid); RNG4.SeedFixedIntegers(seeds);
LatticeColourMatrix Pmu(UGrid);
LatticeGaugeField P(UGrid);
LatticeGaugeField UdSdU(UGrid);
std::cout << GridLogMessage << "*********************************************************"<<std::endl;
std::cout << GridLogMessage << " Force test for "<<action.action_name()<<std::endl;
std::cout << GridLogMessage << "*********************************************************"<<std::endl;
RealD eps=0.005;
Gimpl::generate_momenta(P,sRNG,RNG4);
Filter.applyFilter(P);
action.refresh(U,sRNG,RNG4);
RealD S1 = action.S(U);
Gimpl::update_field(P,U,eps);
action.deriv(U,UdSdU);
UdSdU = Ta(UdSdU);
Filter.applyFilter(UdSdU);
DumpSliceNorm("Force",UdSdU,Nd-1);
Gimpl::update_field(P,U,eps);
RealD S2 = action.S(U);
LatticeComplex dS(UGrid); dS = Zero();
for(int mu=0;mu<Nd;mu++){
auto UdSdUmu = PeekIndex<LorentzIndex>(UdSdU,mu);
Pmu= PeekIndex<LorentzIndex>(P,mu);
dS = dS - trace(Pmu*UdSdUmu)*eps*2.0*2.0;
}
ComplexD dSpred = sum(dS);
RealD diff = S2-S1-dSpred.real();
std::cout<< GridLogMessage << "+++++++++++++++++++++++++++++++++++++++++++++++++++++++++"<<std::endl;
std::cout<< GridLogMessage << "S1 : "<< S1 <<std::endl;
std::cout<< GridLogMessage << "S2 : "<< S2 <<std::endl;
std::cout<< GridLogMessage << "dS : "<< S2-S1 <<std::endl;
std::cout<< GridLogMessage << "dSpred : "<< dSpred.real() <<std::endl;
std::cout<< GridLogMessage << "diff : "<< diff<<std::endl;
std::cout<< GridLogMessage << "diff/dS : "<< diff/(S2-S1)<<std::endl;
std::cout<< GridLogMessage << "*********************************************************"<<std::endl;
std::cout<< GridLogMessage << "Done" <<std::endl;
std::cout << GridLogMessage << "*********************************************************"<<std::endl;
}
int main (int argc, char ** argv)
{
Grid_init(&argc,&argv);
std::cout << std::setprecision(14);
const int Ls=8;
GridCartesian * UGrid = SpaceTimeGrid::makeFourDimGrid(GridDefaultLatt(), GridDefaultSimd(Nd,vComplex::Nsimd()),GridDefaultMpi());
GridRedBlackCartesian * UrbGrid = SpaceTimeGrid::makeFourDimRedBlackGrid(UGrid);
GridCartesian * FGrid = SpaceTimeGrid::makeFiveDimGrid(Ls,UGrid);
GridRedBlackCartesian * FrbGrid = SpaceTimeGrid::makeFiveDimRedBlackGrid(Ls,UGrid);
std::vector<int> seeds4({1,2,3,4});
GridParallelRNG RNG4(UGrid); RNG4.SeedFixedIntegers(seeds4);
LatticeGaugeField U(UGrid);
SU<Nc>::HotConfiguration(RNG4,U);
////////////////////////////////////////////////////////////////
// Operators: quotient pair (V = PV mass 1, M light-ish), Mobius,
// campaign b,c. Heavyish M so CG is quick on a hot configuration.
////////////////////////////////////////////////////////////////
RealD mden = 0.2;
RealD mnum = 1.0;
RealD M5 = 1.8;
RealD b = 1.5;
RealD c = 0.5;
WilsonImplParams p;
p.boundary_phases[0] = 1.0;
p.boundary_phases[1] = 1.0;
p.boundary_phases[2] = 1.0;
p.boundary_phases[3] = -1.0;
MobiusFermionD DenOp(U,*FGrid,*FrbGrid,*UGrid,*UrbGrid,mden,M5,b,c,p);
MobiusFermionD NumOp(U,*FGrid,*FrbGrid,*UGrid,*UrbGrid,mnum,M5,b,c,p);
RealD tol = 1.0e-12;
Integer maxit = 30000;
typedef WilsonImplD::FermionField FermionField;
////////////////////////////////////////////////////////////////
// Solvers. Classic: CG as OperatorFunction on the MdagM linop the
// action supplies. LeftPrec: F-contract solves via CG on FdagF.
////////////////////////////////////////////////////////////////
ConjugateGradient<FermionField> CG(tol,maxit);
VdagMNormalOperator<WilsonImplD> FdagF(NumOp,DenOp);
ForwardFSolve<WilsonImplD> Ffwd (FdagF,tol,maxit);
AdjointFSolve<WilsonImplD> Fadj (FdagF,tol,maxit);
NormalEqSolve<MobiusFermionD,FermionField> VdagVinv(NumOp,tol,maxit);
TwoFlavourRatioPseudoFermionAction<WilsonImplD> Classic (NumOp,DenOp,CG,CG);
TwoFlavourRatioLeftPrecPseudoFermionAction<WilsonImplD> LeftPrec(NumOp,DenOp,Ffwd,Fadj,Fadj,VdagVinv);
////////////////////////////////////////////////////////////////
// Twin-seeded refreshes: identical eta into both classes.
////////////////////////////////////////////////////////////////
std::vector<int> seedsR({9,11,13,17});
GridSerialRNG sRNGa; sRNGa.SeedFixedIntegers(seedsR);
GridSerialRNG sRNGb; sRNGb.SeedFixedIntegers(seedsR);
GridParallelRNG RNG5a(FGrid); RNG5a.SeedFixedIntegers(seedsR);
GridParallelRNG RNG5b(FGrid); RNG5b.SeedFixedIntegers(seedsR);
GridParallelRNG RNG5c(FGrid); RNG5c.SeedFixedIntegers(seedsR);
FermionField etaTwin(FGrid);
gaussian(RNG5c,etaTwin); // identical to both refresh draws
Classic.refresh (U,sRNGa,RNG5a);
LeftPrec.refresh(U,sRNGb,RNG5b);
////////////////////////////////////////////////////////////////
// E0 : heatbath identity for both classes
////////////////////////////////////////////////////////////////
RealD Sexpect = 0.5*norm2(etaTwin);
RealD Sc = Classic.S(U);
RealD Sl = LeftPrec.S(U);
RealD e0a = std::abs(Sc-Sexpect)/Sexpect;
RealD e0b = std::abs(Sl-Sexpect)/Sexpect;
std::cout << GridLogMessage << "=========================================================" << std::endl;
std::cout << GridLogMessage << " E0 heatbath identity: 0.5|eta|^2 = " << Sexpect << std::endl;
std::cout << GridLogMessage << " classic S = " << Sc << " rel defect " << e0a
<< ( e0a < 1.0e-8 ? " PASS" : " FAIL" ) << std::endl;
std::cout << GridLogMessage << " leftprec S = " << Sl << " rel defect " << e0b
<< ( e0b < 1.0e-8 ? " PASS" : " FAIL" ) << std::endl;
////////////////////////////////////////////////////////////////
// E1 : action equivalence
////////////////////////////////////////////////////////////////
RealD e1 = std::abs(Sc-Sl)/std::abs(Sc);
std::cout << GridLogMessage << " E1 action equivalence: rel diff = " << e1
<< ( e1 < 1.0e-8 ? " PASS" : " FAIL" ) << std::endl;
////////////////////////////////////////////////////////////////
// E2 : derivative equivalence (pointwise field comparison)
////////////////////////////////////////////////////////////////
LatticeGaugeField dSdUc(UGrid);
LatticeGaugeField dSdUl(UGrid);
LatticeGaugeField dDiff(UGrid);
Classic.deriv (U,dSdUc);
LeftPrec.deriv(U,dSdUl);
dDiff = dSdUc - dSdUl;
RealD e2 = std::sqrt( norm2(dDiff) / norm2(dSdUc) );
std::cout << GridLogMessage << " E2 deriv equivalence: |diff|/|classic| = " << e2
<< ( e2 < 1.0e-8 ? " PASS" : " FAIL" ) << std::endl;
std::cout << GridLogMessage << " |dSdU classic |^2 = " << norm2(dSdUc) << std::endl;
std::cout << GridLogMessage << " |dSdU leftprec|^2 = " << norm2(dSdUl) << std::endl;
std::cout << GridLogMessage << "=========================================================" << std::endl;
////////////////////////////////////////////////////////////////
// F1 : standalone force test on the LeftPrec class
////////////////////////////////////////////////////////////////
MomentumFilterNone<LatticeGaugeField> FilterNone;
ForceTest<GimplTypesR>(LeftPrec,U,FilterNone);
////////////////////////////////////////////////////////////////
// Summary + hard asserts (this is the regression gate)
////////////////////////////////////////////////////////////////
std::cout << GridLogMessage << "=========================================================" << std::endl;
std::cout << GridLogMessage << " SUMMARY" << std::endl;
std::cout << GridLogMessage << " E0a classic heatbath defect : " << e0a << std::endl;
std::cout << GridLogMessage << " E0b leftprec heatbath defect : " << e0b << std::endl;
std::cout << GridLogMessage << " E1 action equivalence : " << e1 << std::endl;
std::cout << GridLogMessage << " E2 deriv equivalence : " << e2 << std::endl;
std::cout << GridLogMessage << "=========================================================" << std::endl;
GRID_ASSERT(e0a < 1.0e-8);
GRID_ASSERT(e0b < 1.0e-8);
GRID_ASSERT(e1 < 1.0e-8);
GRID_ASSERT(e2 < 1.0e-8);
std::cout << GridLogMessage << "All equivalence tests PASSED" << std::endl;
Grid_finalize();
}