Commits · 266b17049095807962ef3efb02d0e5ffd9b28f11 · nomad-lab / parser-gpaw

16 Jun, 2016 1 commit
- remove PAW meta-info stuff for now · 266b1704
  Mikkel Strange authored Jun 16, 2016
  
  266b1704
15 Jun, 2016 1 commit
- add various x_gpaw_ meta info stuff · 84ca45f4
  Mikkel Strange authored Jun 15, 2016
  
  84ca45f4
14 Jun, 2016 2 commits
- spin pol test cases · 10a4a122
  Mikkel Strange authored Jun 14, 2016
  
  10a4a122
- include info on spin · acfef610
  Mikkel Strange authored Jun 14, 2016
  
  acfef610
13 Jun, 2016 5 commits
- added py file · f202bd31
  Mikkel Strange authored Jun 13, 2016
  
  f202bd31
- removing blank lines... · 0fbaf7c2
  Mikkel Strange authored Jun 13, 2016
  
  0fbaf7c2
- change to libxc naming · 10af0b92
  Mikkel Strange authored Jun 13, 2016
  
  10af0b92
- conv internal xc names to libxc names · 9175fb03
  Mikkel Strange authored Jun 13, 2016
  
  9175fb03
- small update · cf3d6a83
  Mikkel Strange authored Jun 13, 2016
  
  cf3d6a83
19 May, 2016 1 commit
- quick fix for eigenvalues · a3c657e0
  Mohamed, Fawzi Roberto (fawzi) authored May 20, 2016
```
eigenvalues_kpoints looks strange, is it correct?
```
  a3c657e0
17 May, 2016 2 commits
- more renames from web_public · 05116df7
  Mohamed, Fawzi Roberto (fawzi) authored May 17, 2016
  
  05116df7
- applying obvious metadata renames · 506e2d67
  Mohamed, Fawzi Roberto (fawzi) authored May 17, 2016
```
section_system_description -> section_system
cell_associated -> cell_dependent
```
  506e2d67
28 Apr, 2016 1 commit
- Add nomad meta info version and update ci script · a19e12ff
  ankit kariryaa authored Apr 28, 2016
  
  a19e12ff
15 Apr, 2016 1 commit
- adding public.nomadmetainfo · e5d107e8
  Mohamed, Fawzi Roberto (fawzi) authored Apr 15, 2016
  
  e5d107e8
30 Mar, 2016 1 commit
- scalariform · f54c4668
  Mohamed, Fawzi Roberto (fawzi) authored Mar 30, 2016
  
  f54c4668
03 Mar, 2016 2 commits
- test case of si with kpoints and plane waves · 193e5aa7
  Mikkel Strange authored Mar 03, 2016
  
  193e5aa7
- correct spelling error · c79589eb
  Mikkel Strange authored Mar 03, 2016
  
  c79589eb
02 Mar, 2016 1 commit
- added smearing info · 29a455c4
  Mikkel Strange authored Mar 02, 2016
  
  29a455c4
29 Feb, 2016 3 commits
- using new git based versioning... · 14130230
  Mohamed, Fawzi Roberto (fawzi) authored Feb 29, 2016
  
  14130230
- fixing typo (section_system_description)... again · e91ed63f
  Mohamed, Fawzi Roberto (fawzi) authored Feb 29, 2016
```
fix of 3025cbc1 got lost in merge...
```
  e91ed63f
- setup_path had to be imported before nomadcore · 9d957802
  Mohamed, Fawzi Roberto (fawzi) authored Feb 29, 2016
  
  9d957802
23 Feb, 2016 1 commit
- Add gitlab CI config · 7c69c399
  ankit kariryaa authored Feb 23, 2016
  
  7c69c399
11 Feb, 2016 3 commits
- Add test · 852855b8
  ankit kariryaa authored Feb 11, 2016
  
  852855b8
- resolved conflicts · fbb6bb86
  Mikkel Strange authored Feb 11, 2016
  
  fbb6bb86
- updated parser to handle different basis sets · 78cebe38
  Mikkel Strange authored Feb 11, 2016
  
  78cebe38
09 Feb, 2016 5 commits
- remove left over skeleton code · eec077a5
  Mohamed, Fawzi Roberto (fawzi) authored Feb 09, 2016
  
  eec077a5
- fixing scala parser wrapper · 4e99d837
  Mohamed, Fawzi Roberto (fawzi) authored Feb 09, 2016
  
  4e99d837
- importing setup_paths to make python common work in scala · 1478cd4a
  Mohamed, Fawzi Roberto (fawzi) authored Feb 09, 2016
```
(and without module installation)
```
  1478cd4a
- fixing typo (section_system_description) · 3025cbc1
  Mohamed, Fawzi Roberto (fawzi) authored Feb 09, 2016
  
  3025cbc1
- consistent naming of scala parsers · e6255076
  Mohamed, Fawzi Roberto (fawzi) authored Feb 09, 2016
  
  e6255076
28 Jan, 2016 5 commits
- first GPAW parser · de4fced5
  Mikkel Strange authored Jan 28, 2016
  
  de4fced5
- Add driver · 4400c1dd
  Jens J. Mortensen authored Jan 28, 2016
  
  4400c1dd
- Implement 'in' operator · a1efd95f
  Jens J. Mortensen authored Jan 28, 2016
  
  a1efd95f
- Test output file from gpaw · 31dbd14d
  Mikkel Strange authored Jan 28, 2016
  
  31dbd14d
- Tar file reader · 883c9a85
  Jens J. Mortensen authored Jan 28, 2016
  
  883c9a85
12 Jan, 2016 1 commit
- python-common: python -> common/python · af38582e
  Mohamed, Fawzi Roberto (fawzi) authored Jan 13, 2016
  
  af38582e
18 Dec, 2015 2 commits
- section_single_point_evaluation -> section_single_configuration_calculation · 0dad06e4
  Mohamed, Fawzi Roberto (fawzi) authored Dec 18, 2015
  
  0dad06e4
- initial commit: skeleton to use the simple parser infrastructure · eaf7de5e
  Mohamed, Fawzi Roberto (fawzi) authored Dec 18, 2015
  
  eaf7de5e