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PmeGrid Struct Reference

#include <PmeBase.h>

Public Attributes

int K1
 
int K2
 
int K3
 
int dim2
 
int dim3
 
int order
 
int block1
 
int block2
 
int block3
 
int xBlocks
 
int yBlocks
 
int zBlocks
 

Detailed Description

Definition at line 20 of file PmeBase.h.

Member Data Documentation

◆ block1

int PmeGrid::block1

Definition at line 24 of file PmeBase.h.

Referenced by ComputePmeMgr::copyPencils(), ComputeCUDAMgr::createCudaPmeOneDevice(), PmeZPencil::fft_init(), PmeYPencil::fft_init(), ComputePmeMgr::initialize(), ComputePmeMgr::initialize_pencils(), PmeXPencil::recv_trans(), PmeXPencil::send_subset_untrans(), PmeXPencil::send_untrans(), ComputePmeMgr::sendDataPart(), ComputePmeMgr::sendPencils(), ComputePmeMgr::sendPencilsPart(), and ComputePmeCUDAMgr::setupPencils().

◆ block2

int PmeGrid::block2

Definition at line 24 of file PmeBase.h.

Referenced by ComputePmeMgr::copyPencils(), ComputeCUDAMgr::createCudaPmeOneDevice(), PmeZPencil::fft_init(), PmeXPencil::fft_init(), ComputePmeMgr::initialize(), ComputePmeMgr::initialize_pencils(), PmeYPencil::recv_trans(), PmeYPencil::recv_untrans(), PmeYPencil::send_subset_trans(), PmeYPencil::send_subset_untrans(), PmeYPencil::send_trans(), PmeYPencil::send_untrans(), ComputePmeMgr::sendPencils(), ComputePmeMgr::sendPencilsPart(), and ComputePmeCUDAMgr::setupPencils().

◆ block3

int PmeGrid::block3

Definition at line 24 of file PmeBase.h.

Referenced by ComputeCUDAMgr::createCudaPmeOneDevice(), PmeYPencil::fft_init(), PmeXPencil::fft_init(), ComputePmeMgr::initialize(), PmeZPencil::recv_untrans(), PmeZPencil::send_subset_trans(), PmeZPencil::send_trans(), and ComputePmeCUDAMgr::setupPencils().

◆ dim2

int PmeGrid::dim2

Definition at line 22 of file PmeBase.h.

Referenced by PmeRealSpace::compute_forces_order4_partial(), ComputePme::ComputePme(), ComputePmeMgr::copyPencils(), ComputeCUDAMgr::createCudaPmeOneDevice(), PmeYPencil::fft_init(), PmeYPencil::forward_fft(), ComputePmeMgr::gridCalc1(), ComputePmeMgr::gridCalc3(), ComputePmeMgr::initialize(), ComputePmeMgr::initialize_computes(), ComputePmeMgr::sendDataPart(), ComputePmeMgr::sendPencils(), ComputePmeMgr::sendPencilsPart(), and ComputePmeCUDAMgr::setupPencils().

◆ dim3

int PmeGrid::dim3

Definition at line 22 of file PmeBase.h.

Referenced by PmeZPencil::backward_fft(), ComputePme::ComputePme(), ComputePmeMgr::copyPencils(), ComputePmeMgr::copyResults(), ComputeCUDAMgr::createCudaPmeOneDevice(), PmeZPencil::fft_init(), PmeYPencil::fft_init(), PmeXPencil::fft_init(), PmeZPencil::forward_fft(), ComputePmeMgr::gridCalc1(), ComputePmeMgr::gridCalc2(), ComputePmeMgr::gridCalc2R(), ComputePmeMgr::gridCalc3(), ComputePmeMgr::initialize(), ComputePmeMgr::initialize_computes(), PmeZPencil::node_process_untrans(), ComputePmeMgr::procTrans(), ComputePmeMgr::procUntrans(), PmeZPencil::recv_grid(), PmeZPencil::recv_untrans(), ComputePmeMgr::recvGrid(), PmeZPencil::send_subset_trans(), PmeZPencil::send_trans(), PmeZPencil::send_ungrid(), ComputePmeMgr::sendDataPart(), ComputePmeMgr::sendPencilsPart(), ComputePmeMgr::sendTransSubset(), ComputePmeMgr::sendUngridSubset(), ComputePmeMgr::sendUntransSubset(), and ComputePmeCUDAMgr::setupPencils().

◆ K1

int PmeGrid::K1

Definition at line 21 of file PmeBase.h.

Referenced by PmeZPencil::backward_fft(), PmeXPencil::backward_fft(), CudaPmeOneDevice::checkPatchLevelLatticeCompatibilityAndComputeOffsets(), CudaPmeOneDevice::compute(), PmeKSpace::compute_energy(), PmeKSpace::compute_energy_orthogonal_helper(), PmeKSpace::compute_energy_orthogonal_subset(), PmeRealSpace::compute_forces_order4_partial(), ComputePme::ComputePme(), ComputePmeMgr::copyPencils(), ComputeCUDAMgr::createCudaPmeOneDevice(), ComputePmeMgr::cuda_submit_charges(), CudaPmeKSpaceCompute::CudaPmeKSpaceCompute(), CudaPmeOneDevice::CudaPmeOneDevice(), ComputePme::doWork(), PmeZPencil::fft_init(), PmeYPencil::fft_init(), PmeXPencil::fft_init(), PmeAtomFiler::fileAtoms(), PmeXPencil::forward_fft(), CudaPmeRealSpaceCompute::gatherForce(), getPencilDim(), FFTCompute::init(), ComputePmeMgr::initialize(), ComputePmeMgr::initialize_computes(), ComputePmeMgr::initialize_pencils(), PmeKSpace::PmeKSpace(), PmeKSpaceCompute::PmeKSpaceCompute(), PmeXPencil::recv_trans(), scale_coordinates(), PmeXPencil::send_subset_untrans(), PmeXPencil::send_untrans(), ComputePmeMgr::sendPencils(), ComputePmeMgr::sendPencilsPart(), CudaPmeTranspose::setDataPtrsYZX(), CudaPmeTranspose::setDataPtrsZXY(), ComputePmeCUDAMgr::setupPencils(), CudaPmeKSpaceCompute::solve(), CudaPmeRealSpaceCompute::spreadCharge(), and ComputePmeMgr::ungridCalc().

◆ K2

int PmeGrid::K2

Definition at line 21 of file PmeBase.h.

Referenced by PmeZPencil::backward_fft(), PmeYPencil::backward_fft(), PmeYPencil::backward_subset_fft(), CudaPmeOneDevice::checkPatchLevelLatticeCompatibilityAndComputeOffsets(), CudaPmeOneDevice::compute(), PmeKSpace::compute_energy(), PmeKSpace::compute_energy_orthogonal_helper(), PmeKSpace::compute_energy_orthogonal_subset(), PmeRealSpace::compute_forces_order4_partial(), ComputePme::ComputePme(), ComputePmeMgr::copyPencils(), ComputeCUDAMgr::createCudaPmeOneDevice(), ComputePmeMgr::cuda_submit_charges(), CudaPmeKSpaceCompute::CudaPmeKSpaceCompute(), CudaPmeOneDevice::CudaPmeOneDevice(), ComputePme::doWork(), PmeZPencil::fft_init(), PmeYPencil::fft_init(), PmeXPencil::fft_init(), PmeAtomFiler::fileAtoms(), PmeYPencil::forward_fft(), PmeYPencil::forward_subset_fft(), CudaPmeRealSpaceCompute::gatherForce(), ComputePmeCUDAMgr::getHomePencil(), getPencilDim(), getPencilIndexY(), FFTCompute::init(), ComputePmeMgr::initialize(), ComputePmeMgr::initialize_computes(), ComputePmeMgr::initialize_pencils(), PmeKSpace::PmeKSpace(), PmeKSpaceCompute::PmeKSpaceCompute(), ComputePmeMgr::procUntrans(), PmeYPencil::recv_trans(), PmeYPencil::recv_untrans(), scale_coordinates(), PmeYPencil::send_subset_trans(), PmeYPencil::send_subset_untrans(), PmeYPencil::send_trans(), PmeYPencil::send_untrans(), ComputePmeMgr::sendDataPart(), ComputePmeMgr::sendPencils(), ComputePmeMgr::sendPencilsPart(), ComputePmeMgr::sendTransSubset(), ComputePmeMgr::sendUntransSubset(), CudaPmeTranspose::setDataPtrsYZX(), CudaPmeTranspose::setDataPtrsZXY(), ComputePmeCUDAMgr::setupPencils(), CudaPmeKSpaceCompute::solve(), CudaPmeRealSpaceCompute::spreadCharge(), and ComputePmeMgr::ungridCalc().

◆ K3

int PmeGrid::K3

Definition at line 21 of file PmeBase.h.

Referenced by PmeZPencil::backward_fft(), ComputePmeMgr::chargeGridReady(), CudaPmeOneDevice::checkPatchLevelLatticeCompatibilityAndComputeOffsets(), CudaPmeOneDevice::compute(), PmeKSpace::compute_energy(), PmeKSpace::compute_energy_orthogonal_helper(), PmeKSpace::compute_energy_orthogonal_subset(), PmeRealSpace::compute_forces_order4_partial(), ComputePme::ComputePme(), ComputePmeMgr::copyPencils(), ComputePmeMgr::copyResults(), ComputeCUDAMgr::createCudaPmeOneDevice(), ComputePmeMgr::cuda_submit_charges(), CudaPmeKSpaceCompute::CudaPmeKSpaceCompute(), CudaPmeOneDevice::CudaPmeOneDevice(), ComputePme::doWork(), PmeZPencil::fft_init(), PmeAtomFiler::fileAtoms(), PmeZPencil::forward_fft(), CudaPmeRealSpaceCompute::gatherForce(), ComputePmeCUDAMgr::getHomePencil(), getPencilDim(), getPencilIndexZ(), FFTCompute::init(), ComputePmeMgr::initialize(), ComputePmeMgr::initialize_computes(), PmeKSpace::PmeKSpace(), PmeKSpaceCompute::PmeKSpaceCompute(), scale_coordinates(), ComputePmeMgr::sendDataPart(), ComputePmeMgr::sendPencilsPart(), CudaPmeTranspose::setDataPtrsYZX(), CudaPmeTranspose::setDataPtrsZXY(), ComputePmeCUDAMgr::setupPencils(), CudaPmeKSpaceCompute::solve(), CudaPmeRealSpaceCompute::spreadCharge(), and ComputePmeMgr::ungridCalc().

◆ order

int PmeGrid::order

Definition at line 23 of file PmeBase.h.

Referenced by ComputePmeMgr::chargeGridReady(), CudaPmeOneDevice::checkPatchLevelLatticeCompatibilityAndComputeOffsets(), CudaPmeOneDevice::compute(), PmeRealSpace::compute_forces(), ComputePme::ComputePme(), ComputePmeMgr::copyPencils(), ComputePmeMgr::copyResults(), ComputeCUDAMgr::createCudaPmeOneDevice(), ComputePmeMgr::cuda_submit_charges(), CudaPmeOneDevice::CudaPmeOneDevice(), ComputePme::doWork(), PmeAtomFiler::fileAtoms(), PmeRealSpace::fill_charges(), CudaPmeRealSpaceCompute::gatherForce(), ComputePmeCUDAMgr::getHomePencil(), ComputePmeMgr::initialize(), ComputePmeMgr::initialize_computes(), ComputePmeMgr::initialize_pencils(), PmeKSpace::PmeKSpace(), PmeKSpaceCompute::PmeKSpaceCompute(), scale_coordinates(), ComputePmeMgr::sendDataPart(), ComputePmeMgr::sendPencilsPart(), PmeRealSpace::set_num_atoms(), ComputePmeCUDAMgr::setupPencils(), CudaPmeRealSpaceCompute::spreadCharge(), and ComputePmeMgr::ungridCalc().

◆ xBlocks

int PmeGrid::xBlocks

Definition at line 25 of file PmeBase.h.

Referenced by ComputeCUDAMgr::createCudaPmeOneDevice(), getBlockDim(), ComputePmeCUDAMgr::getDevicePencilY(), ComputePmeCUDAMgr::getDevicePencilZ(), getPencilDim(), FFTCompute::init(), PmePencilXY::initBlockSizes(), PmePencilX::initBlockSizes(), ComputePmeCUDAMgr::initialize(), PmeTranspose::PmeTranspose(), and ComputePmeCUDAMgr::setupPencils().

◆ yBlocks

int PmeGrid::yBlocks

Definition at line 25 of file PmeBase.h.

Referenced by ComputeCUDAMgr::createCudaPmeOneDevice(), PmeAtomFiler::fileAtoms(), CudaPmeRealSpaceCompute::gatherForce(), getBlockDim(), ComputePmeCUDAMgr::getDevice(), ComputePmeCUDAMgr::getDevicePencilZ(), ComputePmeCUDAMgr::getHomePencil(), ComputePmeCUDAMgr::getNode(), getPencilDim(), getPencilIndexY(), FFTCompute::init(), PmePencilY::initBlockSizes(), ComputePmeCUDADevice::initialize(), ComputePmeCUDAMgr::initialize(), ComputePmeCUDADevice::initializePatches(), PmeTranspose::PmeTranspose(), ComputePmeCUDADevice::recvAtoms(), ComputePmeCUDADevice::recvAtomsFromNeighbor(), ComputePmeCUDADevice::recvForcesFromNeighbor(), ComputePmeCUDADevice::sendAtomsToNeighbor(), ComputePmeCUDADevice::sendForcesToNeighbors(), ComputePmeCUDAMgr::setupPencils(), and CudaPmeRealSpaceCompute::spreadCharge().

◆ zBlocks

int PmeGrid::zBlocks

Definition at line 25 of file PmeBase.h.

Referenced by ComputeCUDAMgr::createCudaPmeOneDevice(), PmeAtomFiler::fileAtoms(), CudaPmeRealSpaceCompute::gatherForce(), getBlockDim(), ComputePmeCUDAMgr::getDevice(), ComputePmeCUDAMgr::getDevicePencilY(), ComputePmeCUDAMgr::getHomePencil(), ComputePmeCUDAMgr::getNode(), getPencilDim(), getPencilIndexZ(), FFTCompute::init(), PmePencilZ::initBlockSizes(), ComputePmeCUDADevice::initialize(), ComputePmeCUDAMgr::initialize(), ComputePmeCUDADevice::initializePatches(), PmeTranspose::PmeTranspose(), ComputePmeCUDADevice::recvAtoms(), ComputePmeCUDADevice::recvAtomsFromNeighbor(), ComputePmeCUDADevice::recvForcesFromNeighbor(), ComputePmeCUDADevice::sendAtomsToNeighbor(), ComputePmeCUDADevice::sendForcesToNeighbors(), ComputePmeCUDAMgr::setupPencils(), and CudaPmeRealSpaceCompute::spreadCharge().

The documentation for this struct was generated from the following file:
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