Skip to content

GitLab

Explore

Sign in

Primary navigation

Project

P

PuReMD
- Activity
- Members
- Labels
- Issues
- Issue boards
- Milestones
- Iterations
- Wiki
- Requirements
- Releases
- Model registry
- Incidents

Snippets Groups Projects

de461af2

Commit de461af2 authored 6 years ago by Kurt A. O'Hearn

Downloads
- Patches
- Plain Diff

sPuReMD: default to vlist_buffer of 2.5 angstroms. Fixes to cutoffs used in...

sPuReMD: default to vlist_buffer of 2.5 angstroms. Fixes to cutoffs used in far neighbor list generation.

parent f6fe1e80

No related merge requests found

Changes 5

Hide whitespace changes

Inline Side-by-side

Showing

doc/src/manual.tex 3 additions, 3 deletions

doc/src/manual.tex
sPuReMD/src/box.c 201 additions, 109 deletions

sPuReMD/src/box.c
sPuReMD/src/box.h 6 additions, 6 deletions

sPuReMD/src/box.h
sPuReMD/src/control.c 1 addition, 1 deletion

sPuReMD/src/control.c
sPuReMD/src/neighbors.c 6 additions, 4 deletions

sPuReMD/src/neighbors.c

with 217 additions and 123 deletions

Loading

0% Loading or .

You are about to add 0 people to the discussion. Proceed with caution.

Finish editing this message first!

Please register or sign in to comment