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25ba4c5f80
Grid/HMC/Mobius2p1fEOFA.cc
Peter Boyle 25ba4c5f80 Merge branch 'develop' into feature/gpu-port 
Conflicts:
	HMC/Mobius2p1fEOFA.cc
	tests/forces/Test_rect_force.cc
2019-07-19 11:01:55 +01:00

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/*************************************************************************************
Grid physics library, www.github.com/paboyle/Grid
Source file:
Copyright (C) 2015-2016
Author: Peter Boyle <pabobyle@ph.ed.ac.uk>
Author: Guido Cossu
Author: David Murphy
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 */
#include <Grid/Grid.h>
#ifdef GRID_DEFAULT_PRECISION_DOUBLE
#define MIXED_PRECISION
#endif
namespace Grid{
namespace QCD{
/*
* Need a plan for gauge field update for mixed precision in HMC (2x speed up)
* -- Store the single prec action operator.
* -- Clone the gauge field from the operator function argument.
* -- Build the mixed precision operator dynamically from the passed operator and single prec clone.
*/
template<class FermionOperatorD, class FermionOperatorF, class SchurOperatorD, class SchurOperatorF>
class MixedPrecisionConjugateGradientOperatorFunction : public OperatorFunction<typename FermionOperatorD::FermionField> {
public:
typedef typename FermionOperatorD::FermionField FieldD;
typedef typename FermionOperatorF::FermionField FieldF;
using OperatorFunction<FieldD>::operator();
RealD Tolerance;
RealD InnerTolerance; //Initial tolerance for inner CG. Defaults to Tolerance but can be changed
Integer MaxInnerIterations;
Integer MaxOuterIterations;
GridBase* SinglePrecGrid4; //Grid for single-precision fields
GridBase* SinglePrecGrid5; //Grid for single-precision fields
RealD OuterLoopNormMult; //Stop the outer loop and move to a final double prec solve when the residual is OuterLoopNormMult * Tolerance
FermionOperatorF &FermOpF;
FermionOperatorD &FermOpD;;
SchurOperatorF &LinOpF;
SchurOperatorD &LinOpD;
Integer TotalInnerIterations; //Number of inner CG iterations
Integer TotalOuterIterations; //Number of restarts
Integer TotalFinalStepIterations; //Number of CG iterations in final patch-up step
MixedPrecisionConjugateGradientOperatorFunction(RealD tol,
Integer maxinnerit,
Integer maxouterit,
GridBase* _sp_grid4,
GridBase* _sp_grid5,
FermionOperatorF &_FermOpF,
FermionOperatorD &_FermOpD,
SchurOperatorF &_LinOpF,
SchurOperatorD &_LinOpD):
LinOpF(_LinOpF),
LinOpD(_LinOpD),
FermOpF(_FermOpF),
FermOpD(_FermOpD),
Tolerance(tol),
InnerTolerance(tol),
MaxInnerIterations(maxinnerit),
MaxOuterIterations(maxouterit),
SinglePrecGrid4(_sp_grid4),
SinglePrecGrid5(_sp_grid5),
OuterLoopNormMult(100.)
{
/* Debugging instances of objects; references are stored
std::cout << GridLogMessage << " Mixed precision CG wrapper LinOpF " <<std::hex<< &LinOpF<<std::dec <<std::endl;
std::cout << GridLogMessage << " Mixed precision CG wrapper LinOpD " <<std::hex<< &LinOpD<<std::dec <<std::endl;
std::cout << GridLogMessage << " Mixed precision CG wrapper FermOpF " <<std::hex<< &FermOpF<<std::dec <<std::endl;
std::cout << GridLogMessage << " Mixed precision CG wrapper FermOpD " <<std::hex<< &FermOpD<<std::dec <<std::endl;
*/
};
void operator()(LinearOperatorBase<FieldD> &LinOpU, const FieldD &src, FieldD &psi) {
std::cout << GridLogMessage << " Mixed precision CG wrapper operator() "<<std::endl;
SchurOperatorD * SchurOpU = static_cast<SchurOperatorD *>(&LinOpU);
// std::cout << GridLogMessage << " Mixed precision CG wrapper operator() FermOpU " <<std::hex<< &(SchurOpU->_Mat)<<std::dec <<std::endl;
// std::cout << GridLogMessage << " Mixed precision CG wrapper operator() FermOpD " <<std::hex<< &(LinOpD._Mat) <<std::dec <<std::endl;
// Assumption made in code to extract gauge field
// We could avoid storing LinopD reference alltogether ?
assert(&(SchurOpU->_Mat)==&(LinOpD._Mat));
////////////////////////////////////////////////////////////////////////////////////
// Must snarf a single precision copy of the gauge field in Linop_d argument
////////////////////////////////////////////////////////////////////////////////////
typedef typename FermionOperatorF::GaugeField GaugeFieldF;
typedef typename FermionOperatorF::GaugeLinkField GaugeLinkFieldF;
typedef typename FermionOperatorD::GaugeField GaugeFieldD;
typedef typename FermionOperatorD::GaugeLinkField GaugeLinkFieldD;
GridBase * GridPtrF = SinglePrecGrid4;
GridBase * GridPtrD = FermOpD.Umu.Grid();
GaugeFieldF U_f (GridPtrF);
GaugeLinkFieldF Umu_f(GridPtrF);
// std::cout << " Dim gauge field "<<GridPtrF->Nd()<<std::endl; // 4d
// std::cout << " Dim gauge field "<<GridPtrD->Nd()<<std::endl; // 4d
////////////////////////////////////////////////////////////////////////////////////
// Moving this to a Clone method of fermion operator would allow to duplicate the
// physics parameters and decrease gauge field copies
////////////////////////////////////////////////////////////////////////////////////
GaugeLinkFieldD Umu_d(GridPtrD);
for(int mu=0;mu<Nd*2;mu++){
Umu_d = PeekIndex<LorentzIndex>(FermOpD.Umu, mu);
precisionChange(Umu_f,Umu_d);
PokeIndex<LorentzIndex>(FermOpF.Umu, Umu_f, mu);
}
pickCheckerboard(Even,FermOpF.UmuEven,FermOpF.Umu);
pickCheckerboard(Odd ,FermOpF.UmuOdd ,FermOpF.Umu);
////////////////////////////////////////////////////////////////////////////////////
// Could test to make sure that LinOpF and LinOpD agree to single prec?
////////////////////////////////////////////////////////////////////////////////////
/*
GridBase *Fgrid = psi._grid;
FieldD tmp2(Fgrid);
FieldD tmp1(Fgrid);
LinOpU.Op(src,tmp1);
LinOpD.Op(src,tmp2);
std::cout << " Double gauge field "<< norm2(FermOpD.Umu)<<std::endl;
std::cout << " Single gauge field "<< norm2(FermOpF.Umu)<<std::endl;
std::cout << " Test of operators "<<norm2(tmp1)<<std::endl;
std::cout << " Test of operators "<<norm2(tmp2)<<std::endl;
tmp1=tmp1-tmp2;
std::cout << " Test of operators diff "<<norm2(tmp1)<<std::endl;
*/
////////////////////////////////////////////////////////////////////////////////////
// Make a mixed precision conjugate gradient
////////////////////////////////////////////////////////////////////////////////////
MixedPrecisionConjugateGradient<FieldD,FieldF> MPCG(Tolerance,MaxInnerIterations,MaxOuterIterations,SinglePrecGrid5,LinOpF,LinOpD);
std::cout << GridLogMessage << "Calling mixed precision Conjugate Gradient" <<std::endl;
MPCG(src,psi);
}
};
}};
int main(int argc, char **argv) {
using namespace Grid;
using namespace Grid::QCD;
Grid_init(&argc, &argv);
int threads = GridThread::GetThreads();
// here make a routine to print all the relevant information on the run
std::cout << GridLogMessage << "Grid is setup to use " << threads << " threads" << std::endl;
// Typedefs to simplify notation
typedef WilsonImplR FermionImplPolicy;
typedef MobiusFermionR FermionAction;
typedef MobiusFermionF FermionActionF;
typedef MobiusEOFAFermionR FermionEOFAAction;
typedef MobiusEOFAFermionF FermionEOFAActionF;
typedef typename FermionAction::FermionField FermionField;
typedef typename FermionActionF::FermionField FermionFieldF;
typedef Grid::XmlReader Serialiser;
//::::::::::::::::::::::::::::::::::::::::::::::::::::::::::::::::::::
IntegratorParameters MD;
// typedef GenericHMCRunner<LeapFrog> HMCWrapper;
// MD.name = std::string("Leap Frog");
typedef GenericHMCRunner<ForceGradient> HMCWrapper;
MD.name = std::string("Force Gradient");
// typedef GenericHMCRunner<MinimumNorm2> HMCWrapper;
// MD.name = std::string("MinimumNorm2");
MD.MDsteps = 6;
MD.trajL = 1.0;
HMCparameters HMCparams;
HMCparams.StartTrajectory = 590;
HMCparams.Trajectories = 1000;
HMCparams.NoMetropolisUntil= 0;
// "[HotStart, ColdStart, TepidStart, CheckpointStart]\n";
// HMCparams.StartingType =std::string("ColdStart");
HMCparams.StartingType =std::string("CheckpointStart");
HMCparams.MD = MD;
HMCWrapper TheHMC(HMCparams);
// Grid from the command line arguments --grid and --mpi
TheHMC.Resources.AddFourDimGrid("gauge"); // use default simd lanes decomposition
CheckpointerParameters CPparams;
CPparams.config_prefix = "ckpoint_EODWF_lat";
CPparams.rng_prefix = "ckpoint_EODWF_rng";
CPparams.saveInterval = 10;
CPparams.format = "IEEE64BIG";
TheHMC.Resources.LoadNerscCheckpointer(CPparams);
RNGModuleParameters RNGpar;
RNGpar.serial_seeds = "1 2 3 4 5";
RNGpar.parallel_seeds = "6 7 8 9 10";
TheHMC.Resources.SetRNGSeeds(RNGpar);
// Construct observables
// here there is too much indirection
typedef PlaquetteMod<HMCWrapper::ImplPolicy> PlaqObs;
TheHMC.Resources.AddObservable<PlaqObs>();
//////////////////////////////////////////////
const int Ls = 16;
Real beta = 2.13;
Real light_mass = 0.01;
Real strange_mass = 0.04;
Real pv_mass = 1.0;
RealD M5 = 1.8;
RealD b = 1.0;
RealD c = 0.0;
std::vector<Real> hasenbusch({ 0.1, 0.3, 0.6 });
auto GridPtr = TheHMC.Resources.GetCartesian();
auto GridRBPtr = TheHMC.Resources.GetRBCartesian();
auto FGrid = SpaceTimeGrid::makeFiveDimGrid(Ls,GridPtr);
auto FrbGrid = SpaceTimeGrid::makeFiveDimRedBlackGrid(Ls,GridPtr);
Coordinate latt = GridDefaultLatt();
Coordinate mpi = GridDefaultMpi();
Coordinate simdF = GridDefaultSimd(Nd,vComplexF::Nsimd());
Coordinate simdD = GridDefaultSimd(Nd,vComplexD::Nsimd());
auto GridPtrF = SpaceTimeGrid::makeFourDimGrid(latt,simdF,mpi);
auto GridRBPtrF = SpaceTimeGrid::makeFourDimRedBlackGrid(GridPtrF);
auto FGridF = SpaceTimeGrid::makeFiveDimGrid(Ls,GridPtrF);
auto FrbGridF = SpaceTimeGrid::makeFiveDimRedBlackGrid(Ls,GridPtrF);
IwasakiGaugeActionR GaugeAction(beta);
// temporarily need a gauge field
LatticeGaugeField U(GridPtr);
LatticeGaugeFieldF UF(GridPtrF);
// These lines are unecessary if BC are all periodic
std::vector<Complex> boundary = {1,1,1,-1};
FermionAction::ImplParams Params(boundary);
FermionActionF::ImplParams ParamsF(boundary);
double ActionStoppingCondition = 1e-10;
double DerivativeStoppingCondition = 1e-6;
double MaxCGIterations = 30000;
////////////////////////////////////
// Collect actions
////////////////////////////////////
ActionLevel<HMCWrapper::Field> Level1(1);
ActionLevel<HMCWrapper::Field> Level2(8);
////////////////////////////////////
// Strange action
////////////////////////////////////
typedef SchurDiagMooeeOperator<FermionActionF,FermionFieldF> LinearOperatorF;
typedef SchurDiagMooeeOperator<FermionAction ,FermionField > LinearOperatorD;
typedef SchurDiagMooeeOperator<FermionEOFAActionF,FermionFieldF> LinearOperatorEOFAF;
typedef SchurDiagMooeeOperator<FermionEOFAAction ,FermionField > LinearOperatorEOFAD;
typedef MixedPrecisionConjugateGradientOperatorFunction<MobiusFermionD,MobiusFermionF,LinearOperatorD,LinearOperatorF> MxPCG;
typedef MixedPrecisionConjugateGradientOperatorFunction<MobiusEOFAFermionD,MobiusEOFAFermionF,LinearOperatorEOFAD,LinearOperatorEOFAF> MxPCG_EOFA;
// DJM: setup for EOFA ratio (Mobius)
OneFlavourRationalParams OFRp;
OFRp.lo = 0.1;
OFRp.hi = 25.0;
OFRp.MaxIter = 10000;
OFRp.tolerance= 1.0e-9;
OFRp.degree = 14;
OFRp.precision= 50;
MobiusEOFAFermionR Strange_Op_L (U , *FGrid , *FrbGrid , *GridPtr , *GridRBPtr , strange_mass, strange_mass, pv_mass, 0.0, -1, M5, b, c);
MobiusEOFAFermionF Strange_Op_LF(UF, *FGridF, *FrbGridF, *GridPtrF, *GridRBPtrF, strange_mass, strange_mass, pv_mass, 0.0, -1, M5, b, c);
MobiusEOFAFermionR Strange_Op_R (U , *FGrid , *FrbGrid , *GridPtr , *GridRBPtr , pv_mass, strange_mass, pv_mass, -1.0, 1, M5, b, c);
MobiusEOFAFermionF Strange_Op_RF(UF, *FGridF, *FrbGridF, *GridPtrF, *GridRBPtrF, pv_mass, strange_mass, pv_mass, -1.0, 1, M5, b, c);
ConjugateGradient<FermionField> ActionCG(ActionStoppingCondition,MaxCGIterations);
ConjugateGradient<FermionField> DerivativeCG(DerivativeStoppingCondition,MaxCGIterations);
#ifdef MIXED_PRECISION
const int MX_inner = 1000;
// Mixed precision EOFA
LinearOperatorEOFAD Strange_LinOp_L (Strange_Op_L);
LinearOperatorEOFAD Strange_LinOp_R (Strange_Op_R);
LinearOperatorEOFAF Strange_LinOp_LF(Strange_Op_LF);
LinearOperatorEOFAF Strange_LinOp_RF(Strange_Op_RF);
MxPCG_EOFA ActionCGL(ActionStoppingCondition,
MX_inner,
MaxCGIterations,
GridPtrF,
FrbGridF,
Strange_Op_LF,Strange_Op_L,
Strange_LinOp_LF,Strange_LinOp_L);
MxPCG_EOFA DerivativeCGL(DerivativeStoppingCondition,
MX_inner,
MaxCGIterations,
GridPtrF,
FrbGridF,
Strange_Op_LF,Strange_Op_L,
Strange_LinOp_LF,Strange_LinOp_L);
MxPCG_EOFA ActionCGR(ActionStoppingCondition,
MX_inner,
MaxCGIterations,
GridPtrF,
FrbGridF,
Strange_Op_RF,Strange_Op_R,
Strange_LinOp_RF,Strange_LinOp_R);
MxPCG_EOFA DerivativeCGR(DerivativeStoppingCondition,
MX_inner,
MaxCGIterations,
GridPtrF,
FrbGridF,
Strange_Op_RF,Strange_Op_R,
Strange_LinOp_RF,Strange_LinOp_R);
ExactOneFlavourRatioPseudoFermionAction<FermionImplPolicy>
EOFA(Strange_Op_L, Strange_Op_R,
ActionCG,
ActionCGL, ActionCGR,
DerivativeCGL, DerivativeCGR,
OFRp, true);
#else
ExactOneFlavourRatioPseudoFermionAction<FermionImplPolicy>
EOFA(Strange_Op_L, Strange_Op_R,
ActionCG,
ActionCG,
ActionCG, ActionCG,
DerivativeCG, DerivativeCG,
OFRp, true);
#endif
Level1.push_back(&EOFA);
////////////////////////////////////
// up down action
////////////////////////////////////
std::vector<Real> light_den;
std::vector<Real> light_num;
int n_hasenbusch = hasenbusch.size();
light_den.push_back(light_mass);
for(int h=0;h<n_hasenbusch;h++){
light_den.push_back(hasenbusch[h]);
light_num.push_back(hasenbusch[h]);
}
light_num.push_back(pv_mass);
//////////////////////////////////////////////////////////////
// Forced to replicate the MxPCG and DenominatorsF etc.. because
// there is no convenient way to "Clone" physics params from double op
// into single op for any operator pair.
// Same issue prevents using MxPCG in the Heatbath step
//////////////////////////////////////////////////////////////
std::vector<FermionAction *> Numerators;
std::vector<FermionAction *> Denominators;
std::vector<TwoFlavourEvenOddRatioPseudoFermionAction<FermionImplPolicy> *> Quotients;
std::vector<MxPCG *> ActionMPCG;
std::vector<MxPCG *> MPCG;
std::vector<FermionActionF *> DenominatorsF;
std::vector<LinearOperatorD *> LinOpD;
std::vector<LinearOperatorF *> LinOpF;
for(int h=0;h<n_hasenbusch+1;h++){
std::cout << GridLogMessage << " 2f quotient Action "<< light_num[h] << " / " << light_den[h]<< std::endl;
Numerators.push_back (new FermionAction(U,*FGrid,*FrbGrid,*GridPtr,*GridRBPtr,light_num[h],M5,b,c, Params));
Denominators.push_back(new FermionAction(U,*FGrid,*FrbGrid,*GridPtr,*GridRBPtr,light_den[h],M5,b,c, Params));
#ifdef MIXED_PRECISION
////////////////////////////////////////////////////////////////////////////
// Mixed precision CG for 2f force
////////////////////////////////////////////////////////////////////////////
DenominatorsF.push_back(new FermionActionF(UF,*FGridF,*FrbGridF,*GridPtrF,*GridRBPtrF,light_den[h],M5,b,c, ParamsF));
LinOpD.push_back(new LinearOperatorD(*Denominators[h]));
LinOpF.push_back(new LinearOperatorF(*DenominatorsF[h]));
MPCG.push_back(new MxPCG(DerivativeStoppingCondition,
MX_inner,
MaxCGIterations,
GridPtrF,
FrbGridF,
*DenominatorsF[h],*Denominators[h],
*LinOpF[h], *LinOpD[h]) );
ActionMPCG.push_back(new MxPCG(ActionStoppingCondition,
MX_inner,
MaxCGIterations,
GridPtrF,
FrbGridF,
*DenominatorsF[h],*Denominators[h],
*LinOpF[h], *LinOpD[h]) );
// Heatbath not mixed yet. As inverts numerators not so important as raised mass.
Quotients.push_back (new TwoFlavourEvenOddRatioPseudoFermionAction<FermionImplPolicy>(*Numerators[h],*Denominators[h],*MPCG[h],*ActionMPCG[h],ActionCG));
#else
////////////////////////////////////////////////////////////////////////////
// Standard CG for 2f force
////////////////////////////////////////////////////////////////////////////
Quotients.push_back (new TwoFlavourEvenOddRatioPseudoFermionAction<FermionImplPolicy>(*Numerators[h],*Denominators[h],DerivativeCG,ActionCG));
#endif
}
for(int h=0;h<n_hasenbusch+1;h++){
Level1.push_back(Quotients[h]);
}
/////////////////////////////////////////////////////////////
// Gauge action
/////////////////////////////////////////////////////////////
Level2.push_back(&GaugeAction);
TheHMC.TheAction.push_back(Level1);
TheHMC.TheAction.push_back(Level2);
std::cout << GridLogMessage << " Action complete "<< std::endl;
/////////////////////////////////////////////////////////////
// HMC parameters are serialisable
std::cout << GridLogMessage << " Running the HMC "<< std::endl;
TheHMC.Run(); // no smearing
Grid_finalize();
} // main
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