PG-PuReMD: add missing dual QEq solver implementations for MPI. (cf7bb182) · Commits · SParTA / PuReMD · GitLab

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cf7bb182

Commit cf7bb182 authored 3 years ago by Kurt A. O'Hearn

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PG-PuReMD: add missing dual QEq solver implementations for MPI.

parent 1ad26c47

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PG-PuReMD/src/allocate.c 56 additions, 0 deletions

PG-PuReMD/src/allocate.c
PG-PuReMD/src/charges.c 6 additions, 12 deletions

PG-PuReMD/src/charges.c
PG-PuReMD/src/init_md.c 28 additions, 0 deletions

PG-PuReMD/src/init_md.c
PG-PuReMD/src/lin_alg.c 686 additions, 32 deletions

PG-PuReMD/src/lin_alg.c
PG-PuReMD/src/lin_alg.h 15 additions, 0 deletions

PG-PuReMD/src/lin_alg.h

with 791 additions and 44 deletions

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