| sc::R12IntsAcc_MPIIOFile_Ind(3) | MPQC | sc::R12IntsAcc_MPIIOFile_Ind(3) |
sc::R12IntsAcc_MPIIOFile_Ind
Inherits sc::R12IntsAcc_MPIIOFile.
R12IntsAcc_MPIIOFile_Ind (Ref< MemoryGrp
> &mem, const char *filename, int num_te_types, int ni,
int nj, int nx, int ny)
R12IntsAcc_MPIIOFile_Ind (StateIn &)
void save_data_state (StateOut &)
Save the base classes (with save_data_state) and the members in the same order
that the StateIn CTOR initializes them. void store_memorygrp
(Ref< MemoryGrp > &mem, int ni, const size_t
blksize=0)
Stores all pair block of integrals held in mem. double *
retrieve_pair_block (int i, int j, tbint_type oper_type)
Retrieves an ij pair block of integrals from the file.
Retrieves an ij pair block of integrals from the file.
Implements sc::R12IntsAcc.
Save the base classes (with save_data_state) and the members in the same order that the StateIn CTOR initializes them. This must be implemented by the derived class if the class has data.
Reimplemented from sc::R12IntsAcc_MPIIOFile.
Stores all pair block of integrals held in mem. By default blocks are appended to the end of the same file, i.e. they are assumed to have come from consecutive passes of the same transformation. This is a collective operation. See documentation for R12IntsAcc::store_memorygrp() for more info.
Implements sc::R12IntsAcc.
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| Fri Dec 2 2022 | Version 2.3.1 |