Commits · 6e4654fa3b016fa099104d3f33078c510c980434 · nomad-lab / parser-vasp

13 Mar, 2020 1 commit
- Fixed adding INCARs with no metainfo to the backend. · 6e4654fa
  Markus Scheidgen authored Mar 13, 2020
  
  6e4654fa
25 Feb, 2020 2 commits
- nomad-lab/parser-vasp#2. Support for tetrahedron and nose params · 5f07d80f
  temok-mx authored Feb 25, 2020
  
  5f07d80f
- Merge commit 'b6c4adc3 ' into nomad-fair2 · 3bc3fdd1
  temok-mx authored Feb 25, 2020
  
  3bc3fdd1
24 Feb, 2020 2 commits
- nomad-FAIR#284 . String-formatting parameters %(...) were not enclosed in parenthesis · 931d29bb
  temok-mx authored Feb 24, 2020
  
  931d29bb
- nomad-FAIR#284 . String-formatting parameters %(...) were not enclosed in parenthesis · b6c4adc3
  temok-mx authored Feb 24, 2020
  
  b6c4adc3
07 Nov, 2019 1 commit
- Relaxed parser error after xml parse error. · d9c9b3c1
  Markus Scheidgen authored Nov 07, 2019
  
  d9c9b3c1
05 Nov, 2019 1 commit
- Updated all VASPs incars as in VASPs wiki · 01427529
  temok-mx authored Nov 05, 2019
  
  01427529
17 Oct, 2019 1 commit
- Added xz compression · 7d850bd7
  Alvin Noe Ladines authored Oct 17, 2019
  
  7d850bd7
15 Oct, 2019 1 commit
- Fixed missing variable error. · dc59aff1
  Markus Scheidgen authored Oct 15, 2019
  
  dc59aff1
08 May, 2019 2 commits
- fixed cos() import issue. · 34041b66
  Daniel Speckhard authored May 08, 2019
  
  34041b66
- changed logging message. · 3bb3b6e2
  Daniel Speckhard authored May 08, 2019
  
  3bb3b6e2
07 May, 2019 1 commit
- changed warning level when no x structure. · 7b10416a
  Daniel Speckhard authored May 07, 2019
  
  7b10416a
28 Mar, 2019 1 commit
- Fixed wrong units. · 039ed6cb
  Markus Scheidgen authored Mar 28, 2019
  
  039ed6cb
14 Mar, 2019 1 commit
- Fixed code name. · 190b1dc1
  Markus Scheidgen authored Mar 14, 2019
  
  190b1dc1
06 Mar, 2019 1 commit
- Reduced warnings. · aa7414da
  Markus Scheidgen authored Mar 06, 2019
  
  aa7414da
13 Feb, 2019 1 commit
- Added support for compressed .xml files. · 386c64df
  Markus Scheidgen authored Feb 13, 2019
  
  386c64df
04 Feb, 2019 1 commit
- Added minimar OUTCAR parser that can be used in absence of .xml to create repository meta data. · 05e5f608
  Markus Scheidgen authored Feb 04, 2019
  
  05e5f608
28 Sep, 2018 1 commit
- Revised logging. · 3670915d
  Markus Scheidgen authored Sep 28, 2018
  
  3670915d
25 Sep, 2018 2 commits
- Fixed setup. · 124adddc
  Markus Scheidgen authored Sep 25, 2018
  
  124adddc
- Refactoring and logging. · 29d54775
  Markus Scheidgen authored Sep 25, 2018
  
  29d54775
21 Sep, 2018 1 commit
- Fixed setup to find packages. · 7c97a280
  Markus Scheidgen authored Sep 21, 2018
  
  7c97a280
08 Aug, 2018 1 commit
- Fixed 'relative' imports. · 9eef65da
  Markus Scheidgen authored Aug 08, 2018
  
  9eef65da
20 Jul, 2018 1 commit
- Merge branch 'auto-license-info' into 'master' · ddf84959
  Markus Scheidgen authored Jul 20, 2018
```
Automatized changes to license and copyright information

See merge request nomad-lab/parser-vasp!1
```
  ddf84959
13 Jul, 2018 1 commit
- Added copyright statements and license. · 46e5a8d1
  Markus Scheidgen authored Jul 13, 2018
  
  46e5a8d1
03 May, 2018 1 commit
- fix integrated dos value · abf9f966
  Mohamed, Fawzi Roberto (fawzi) authored May 03, 2018
  
  abf9f966
08 Dec, 2017 1 commit
- Fixed another bug in the DOS conversion. · 25b4bf58
  Lauri Himanen authored Dec 08, 2017
  
  25b4bf58
09 Nov, 2017 1 commit
- fixing vasprun parser · be32d304
  Mohamed, Fawzi Roberto (fawzi) authored Nov 09, 2017
  
  be32d304
25 Oct, 2017 1 commit
- license header for scala files · f00ab2d4
  Mohamed, Fawzi Roberto (fawzi) authored Oct 26, 2017
  
  f00ab2d4
19 Oct, 2017 5 commits
- Trying to get the directories right in scala. · 2d46bf4b
  Lauri Himanen authored Oct 19, 2017
  
  2d46bf4b
- Trying to get the directories right in scala. · ec2b3688
  Lauri Himanen authored Oct 19, 2017
  
  ec2b3688
- Trying to get the directories right in scala. · 23435f7a
  Lauri Himanen authored Oct 19, 2017
  
  23435f7a
- Fixed nomadcore and parser imports in setup_paths.py. · 95c20ff7
  Lauri Himanen authored Oct 19, 2017
  
  95c20ff7
- Fixed naming issue in scala. · cd74ceef
  Lauri Himanen authored Oct 19, 2017
  
  cd74ceef
18 Oct, 2017 1 commit

Modified the parser to use a more uniform project structure, added an... · bad89f73

Lauri Himanen authored Oct 18, 2017

Modified the parser to use a more uniform project structure, added an installation script, added a couple more regtests, fixed issue with undeclared variable and array sizing.

bad89f73

17 Oct, 2017 1 commit
- moving section_basis_set to where section_single_configuration_calculation is open · c4e7b25e
  Mohamed, Fawzi Roberto (fawzi) authored Oct 17, 2017
  
  c4e7b25e
16 Oct, 2017 1 commit
- reverting to old meta name (to make all breaking changes together) · 24449da4
  Mohamed, Fawzi Roberto (fawzi) authored Oct 16, 2017
  
  24449da4
05 Oct, 2017 1 commit
- Fixed an issue that caused by the DOS values being scaled twice with the unit cell volume. · dd98f845
  Lauri Himanen authored Oct 05, 2017
  
  dd98f845
28 Sep, 2017 3 commits
- Revert "mapping_section_method_basis_set_cell_dependent is wrong, correct is... · 0ed98bdd
  Mohamed, Fawzi Roberto (fawzi) authored Sep 28, 2017
```
Revert "mapping_section_method_basis_set_cell_dependent is wrong, correct is mapping_section_basis_set_cell_dependent"

This reverts commit 5b73ec14.
```
  0ed98bdd
- mapping_section_method_basis_set_cell_dependent is wrong, correct is... · 5b73ec14
  Simoes Brambila, Danilo (brambila) authored Sep 28, 2017
```
mapping_section_method_basis_set_cell_dependent is wrong, correct is mapping_section_basis_set_cell_dependent
```
  5b73ec14
- improve basis set info output · 34d1fcb7
  Mohamed, Fawzi Roberto (fawzi) authored Sep 28, 2017
  
  34d1fcb7