PuReMD: include charge matrix fill in timing for performance comparison (e206fb08) · Commits · SParTA / PuReMD · GitLab

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e206fb08

Commit e206fb08 authored 6 years ago by Alperen, Abdullah

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PuReMD: include charge matrix fill in timing for performance comparison

parent c8ce1e0d

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Changes 6

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PuReMD/src/forces.c 25 additions, 6 deletions

PuReMD/src/forces.c
PuReMD/src/init_md.c 2 additions, 2 deletions

PuReMD/src/init_md.c
PuReMD/src/io_tools.c 3 additions, 3 deletions

PuReMD/src/io_tools.c
PuReMD/src/linear_solvers.c 1 addition, 1 deletion

PuReMD/src/linear_solvers.c
PuReMD/src/qEq.c 65 additions, 61 deletions

PuReMD/src/qEq.c
PuReMD/src/reax_types.h 2 additions, 2 deletions

PuReMD/src/reax_types.h

with 98 additions and 75 deletions

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