Start with run
This commit is contained in:
parent
7029ccda2a
commit
672d5ce82c
32
README.org
32
README.org
@ -1886,18 +1886,8 @@ Output Atrip::run(Input const& in){
|
|||||||
// Timings in seconds ================================================{{{1
|
// Timings in seconds ================================================{{{1
|
||||||
Timings chrono{};
|
Timings chrono{};
|
||||||
|
|
||||||
// Get the distributed ctf tensor data
|
No = in.ei->lens[0];
|
||||||
CTF::Tensor<> *ei(getTensorArgument("HoleEigenEnergies"))
|
Nv = in.ea->lens[0];
|
||||||
, *ea(getTensorArgument("ParticleEigenEnergies"))
|
|
||||||
, *Tph(getTensorArgument("CcsdSinglesAmplitudes"))
|
|
||||||
, *Tpphh(getTensorArgument("CcsdDoublesAmplitudes"))
|
|
||||||
, *Vpphh(getTensorArgument("PPHHCoulombIntegrals"))
|
|
||||||
, *Vhhhp(getTensorArgument("HHHPCoulombIntegrals"))
|
|
||||||
, *Vppph(getTensorArgument("PPPHCoulombIntegrals"))
|
|
||||||
;
|
|
||||||
|
|
||||||
No = ei->lens[0];
|
|
||||||
Nv = ea->lens[0];
|
|
||||||
LOG(0,"NEW_TRIPLES") << "No: " << No << "\n";
|
LOG(0,"NEW_TRIPLES") << "No: " << No << "\n";
|
||||||
LOG(0,"NEW_TRIPLES") << "Nv: " << Nv << "\n";
|
LOG(0,"NEW_TRIPLES") << "Nv: " << Nv << "\n";
|
||||||
|
|
||||||
@ -1911,9 +1901,9 @@ Output Atrip::run(Input const& in){
|
|||||||
, Tai(No * Nv)
|
, Tai(No * Nv)
|
||||||
;
|
;
|
||||||
|
|
||||||
ei->read_all(epsi.data());
|
in.ei->read_all(epsi.data());
|
||||||
ea->read_all(epsa.data());
|
in.ea->read_all(epsa.data());
|
||||||
Tph->read_all(Tai.data());
|
in.Tph->read_all(Tai.data());
|
||||||
|
|
||||||
// COMMUNICATOR CONSTRUCTION ========================================={{{1
|
// COMMUNICATOR CONSTRUCTION ========================================={{{1
|
||||||
//
|
//
|
||||||
@ -1929,7 +1919,7 @@ Output Atrip::run(Input const& in){
|
|||||||
if (np == 1) {
|
if (np == 1) {
|
||||||
child_comm = universe;
|
child_comm = universe;
|
||||||
} else {
|
} else {
|
||||||
MPI_Comm_split(cc4s::Cc4s::world->comm, color, crank, &child_comm);
|
MPI_Comm_split(universe, color, crank, &child_comm);
|
||||||
MPI_Comm_rank(child_comm, &child_rank);
|
MPI_Comm_rank(child_comm, &child_rank);
|
||||||
MPI_Comm_size(child_comm, &child_size);
|
MPI_Comm_size(child_comm, &child_size);
|
||||||
//CTF::World child_world(child_comm);
|
//CTF::World child_world(child_comm);
|
||||||
@ -1939,16 +1929,16 @@ Output Atrip::run(Input const& in){
|
|||||||
chrono["nv-slices"].start();
|
chrono["nv-slices"].start();
|
||||||
// BUILD SLICES PARAMETRIZED BY NV ==================================={{{1
|
// BUILD SLICES PARAMETRIZED BY NV ==================================={{{1
|
||||||
LOG(0,"NEW_TRIPLES") << "BUILD NV-SLICES\n";
|
LOG(0,"NEW_TRIPLES") << "BUILD NV-SLICES\n";
|
||||||
TAPHH taphh(*Tpphh, (size_t)No, (size_t)Nv, (size_t)np, child_comm, universe);
|
TAPHH taphh(*in.Tpphh, (size_t)No, (size_t)Nv, (size_t)np, child_comm, universe);
|
||||||
HHHA hhha(*Vhhhp, (size_t)No, (size_t)Nv, (size_t)np, child_comm, universe);
|
HHHA hhha(*in.Vhhhp, (size_t)No, (size_t)Nv, (size_t)np, child_comm, universe);
|
||||||
chrono["nv-slices"].stop();
|
chrono["nv-slices"].stop();
|
||||||
|
|
||||||
chrono["nv-nv-slices"].start();
|
chrono["nv-nv-slices"].start();
|
||||||
// BUILD SLICES PARAMETRIZED BY NV x NV =============================={{{1
|
// BUILD SLICES PARAMETRIZED BY NV x NV =============================={{{1
|
||||||
LOG(0,"NEW_TRIPLES") << "BUILD NV x NV-SLICES\n";
|
LOG(0,"NEW_TRIPLES") << "BUILD NV x NV-SLICES\n";
|
||||||
ABPH abph(*Vppph, (size_t)No, (size_t)Nv, (size_t)np, child_comm, universe);
|
ABPH abph(*in.Vppph, (size_t)No, (size_t)Nv, (size_t)np, child_comm, universe);
|
||||||
ABHH abhh(*Vpphh, (size_t)No, (size_t)Nv, (size_t)np, child_comm, universe);
|
ABHH abhh(*in.Vpphh, (size_t)No, (size_t)Nv, (size_t)np, child_comm, universe);
|
||||||
TABHH tabhh(*Tpphh, (size_t)No, (size_t)Nv, (size_t)np, child_comm, universe);
|
TABHH tabhh(*in.Tpphh, (size_t)No, (size_t)Nv, (size_t)np, child_comm, universe);
|
||||||
chrono["nv-nv-slices"].stop();
|
chrono["nv-nv-slices"].stop();
|
||||||
|
|
||||||
// all tensors
|
// all tensors
|
||||||
|
|||||||
Loading…
Reference in New Issue
Block a user