Commits · f9bbfbb74202b345eaec3e9300c9097a827410ae · nomad-lab / nomad-meta-info

28 Jul, 2018 1 commit
- cascade (with fixes to v1 deps paths) · f9bbfbb7
  Mohamed, Fawzi Roberto (fawzi) authored Jul 29, 2018
  
  f9bbfbb7
26 Jul, 2018 3 commits
- using metaInfoTool cascade... · 72d62a64
  Mohamed, Fawzi Roberto (fawzi) authored Jul 26, 2018
  
  72d62a64
- enact renames · f459e98b
  Mohamed, Fawzi Roberto (fawzi) authored Jul 26, 2018
  
  f459e98b
- renames reverted · 5952bcba
  Mohamed, Fawzi Roberto (fawzi) authored Jul 26, 2018
  
  5952bcba
25 Jul, 2018 1 commit
- complete conversion with renames · 0d041f48
  Mohamed, Fawzi Roberto (fawzi) authored Jul 25, 2018
  
  0d041f48
24 May, 2018 1 commit
- fix dftb atom (but bad prefix choice still to be fixed) · ce7cbe71
  Mohamed, Fawzi Roberto (fawzi) authored May 24, 2018
  
  ce7cbe71
04 Nov, 2016 1 commit
- added meta info for max force component of moving atoms · f78a90b1
  Adriel Domínguez authored Nov 04, 2016
  
  f78a90b1
26 Oct, 2016 2 commits
- added eigenvalue and filling matainfo · 2e37c188
  Adriel Domínguez authored Oct 26, 2016
  
  2e37c188
- Added atomic charge metadata · 56185aaa
  Adriel Domínguez authored Oct 26, 2016
  
  56185aaa
04 Oct, 2016 1 commit
- add "repeat":true feature in metainfo · f80044ca
  Adriel Domínguez authored Oct 04, 2016
  
  f80044ca
03 Oct, 2016 1 commit
- add "repeats": true to meatinfos for x_dftbp_atom_positions_Z and x_dftbp_atom_forces_Z · 4c4a8a0e
  Adriel Domínguez authored Oct 03, 2016
  
  4c4a8a0e
30 Sep, 2016 1 commit
- add metadata for dftb_plus · 3fbab517
  Adriel Domínguez authored Sep 30, 2016
  
  3fbab517
13 Sep, 2016 1 commit
- adding placeholder for forgotten dftb plus metainfo · a83c7f4d
  Mohamed, Fawzi Roberto (fawzi) authored Sep 13, 2016
  
  a83c7f4d
12 Sep, 2016 1 commit
- asap metainfo · 0f5982b1
  Mikkel Strange authored Sep 12, 2016
  
  0f5982b1
28 Jun, 2016 1 commit
- mopac meta info · d40764ce
  Mikkel Strange authored Jun 28, 2016
  
  d40764ce
11 Dec, 2015 1 commit
- added meta info for sample_parser · afd9ef8d
  Mohamed, Fawzi Roberto (fawzi) authored Dec 12, 2015
  
  afd9ef8d
24 Nov, 2015 1 commit
- moving meta info to meta_info sub directory to have cleaner resources · ac06b7c7
  Mohamed, Fawzi Roberto (fawzi) authored Nov 24, 2015
  
  ac06b7c7
18 Oct, 2015 2 commits
- normalize json · 3736d17a
  Mohamed, Fawzi Roberto (fawzi) authored Oct 19, 2015
  
  3736d17a
- fix json errors (incorrect commas) · 6041d9ff
  Mohamed, Fawzi Roberto (fawzi) authored Oct 18, 2015
  
  6041d9ff
09 Oct, 2015 1 commit
- fixing errors in new dictionary, temporarily removing fhi from main · d4a51a95
  Mohamed, Fawzi Roberto (fawzi) authored Oct 09, 2015
```
fhi is not yet fully converted
```
  d4a51a95
01 Oct, 2015 1 commit
- first version (very preliminary) of the metadata · 107e20f9
  Mohamed, Fawzi Roberto (fawzi) authored Oct 01, 2015
  
  107e20f9