Skip to content

GitLab

Explore

Sign in

Primary navigation

Project

P

parser-nwchem
- Activity
- Members

Snippets Groups Projects

This is an archived project. Repository and other project resources are read-only.

0e7820e6

Commit 0e7820e6 authored 7 years ago by Lauri Himanen

Downloads
- Patches
- Plain Diff

Fixed issue in recognizing version ID, added support for parsing VWN5 correlation function.

parent 6987d953

No related branches found

No related tags found

No related merge requests found

Changes 5

Expand all Hide whitespace changes

Inline Side-by-side

Showing

parser/parser-nwchem/nwchemparser/parser.py 1 addition, 1 deletion

parser/parser-nwchem/nwchemparser/parser.py
parser/parser-nwchem/nwchemparser/versions/nwchem66/mainparser.py 5 additions, 2 deletions

...arser-nwchem/nwchemparser/versions/nwchem66/mainparser.py
regtests/nwchem_6.6/dft_gaussian/functionals/slater_vwn5/aluminium.nw 279 additions, 0 deletions

...hem_6.6/dft_gaussian/functionals/slater_vwn5/aluminium.nw
regtests/nwchem_6.6/dft_gaussian/functionals/slater_vwn5/output.out 5309 additions, 0 deletions

...wchem_6.6/dft_gaussian/functionals/slater_vwn5/output.out
regtests/regtests.py 4 additions, 0 deletions

regtests/regtests.py

with 5598 additions and 3 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