sPuReMD: resolve issues with SMALL_BOX_SUPPORT. (e1460c68) · Commits · SParTA / PuReMD · GitLab

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e1460c68

Commit e1460c68 authored 6 years ago by Kurt A. O'Hearn

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sPuReMD: resolve issues with SMALL_BOX_SUPPORT.

parent da7b9380

No related merge requests found

Changes 10

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environ/param.gpu.water 2 additions, 1 deletion

environ/param.gpu.water
sPuReMD/src/analyze.c 1 addition, 1 deletion

sPuReMD/src/analyze.c
sPuReMD/src/box.c 107 additions, 78 deletions

sPuReMD/src/box.c
sPuReMD/src/box.h 13 additions, 9 deletions

sPuReMD/src/box.h
sPuReMD/src/grid.c 31 additions, 35 deletions

sPuReMD/src/grid.c
sPuReMD/src/init_md.c 7 additions, 7 deletions

sPuReMD/src/init_md.c
sPuReMD/src/integrate.c 2 additions, 2 deletions

sPuReMD/src/integrate.c
sPuReMD/src/neighbors.c 44 additions, 182 deletions

sPuReMD/src/neighbors.c
sPuReMD/src/neighbors.h 1 addition, 1 deletion

sPuReMD/src/neighbors.h
sPuReMD/src/reax_types.h 1 addition, 1 deletion

sPuReMD/src/reax_types.h

with 209 additions and 317 deletions

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