Commits · master · Oliver / ase · GitLab

Oct 19, 2016
- changed naming in restartfile · 0fba401d
  CoCo1 authored Oct 19, 2016
  
  0fba401d
Sep 28, 2016
- Finite Differnce Calculator · 08df4c99
  CoCo1 authored Sep 28, 2016
  
  08df4c99
Sep 26, 2016
- Merge branch 'master' of https://gitlab.com/OliverS/ase · b9e2b306
  OStauffert authored Sep 26, 2016
  
  b9e2b306
- Drop EpyDoc. I don't have time to keep it running · cc7546be
  Jens Jørgen Mortensen authored Sep 26, 2016
  
  cc7546be
- Merge branch 'master' of gitlab.com:ase/ase · cdd59e6a
  Jens Jørgen Mortensen authored Sep 26, 2016
  
  cdd59e6a
- Improved file format guessing for cif files · 4e4f6c45
  Jens Jørgen Mortensen authored Sep 26, 2016
  
  4e4f6c45
- Merge branch 'full_element_mut' into 'master' · e8ae7eef
  Jens Jørgen Mortensen authored Sep 26, 2016
  e8ae7eef
- Merge branch 'master' of gitlab.com:ase/ase · 9e683ee5
  Jens Jørgen Mortensen authored Sep 26, 2016
  
  9e683ee5
- Merge branch 'stly/ase-integer-from-ase-db-cli' · 9194f7ab
  Jens Jørgen Mortensen authored Sep 26, 2016
  
  9194f7ab
- Drop the old convert_str_to_float_or_str() function · f35228a7
  Jens Jørgen Mortensen authored Sep 26, 2016
  
  f35228a7
- Merge branch 'nnmat_changes' into 'master' · cbcfd438
  Jens Jørgen Mortensen authored Sep 26, 2016
  cbcfd438
- PEP8 · c5914ebc
  Jens Jørgen Mortensen authored Sep 26, 2016
  
  c5914ebc
- Merge branch 'master' into mwalter/ase-rraman_select · 1d7a8d37
  Jens Jørgen Mortensen authored Sep 26, 2016
  
  1d7a8d37
- Merge branch 'master' of gitlab.com:ase/ase · baee2c9f
  Jens Jørgen Mortensen authored Sep 26, 2016
  
  baee2c9f
- Merge branch 'mbarbry/ase-raman-siesta' · 53665d79
  Jens Jørgen Mortensen authored Sep 26, 2016
  
  53665d79
- PEP8 and also remove repeated dict key: focalpoint · 26f0ca73
  Jens Jørgen Mortensen authored Sep 26, 2016
  
  26f0ca73
- Merge branch 'generic-castep-cell-blocks' into 'master' · a0ac70b8
  Jens Jørgen Mortensen authored Sep 26, 2016
  a0ac70b8
- Merge branch 'fix-supercell-generation' into 'master' · 011b769c
  Jens Jørgen Mortensen authored Sep 26, 2016
  011b769c
- Merge branch 'Ed_Tait/ase-add-onetep-calc' · b8dc2b78
  Jens Jørgen Mortensen authored Sep 26, 2016
  
  b8dc2b78
- Simplify · 4b77ae98
  Jens Jørgen Mortensen authored Sep 26, 2016
  
  4b77ae98
- Update release notes and fix link. · e34c905a
  Jens Jørgen Mortensen authored Sep 26, 2016
  
  e34c905a
- Rename test · cdff0c6a
  Jens Jørgen Mortensen authored Sep 26, 2016
  
  cdff0c6a
- Use ase.test.equal and add link from frontpage · e2322482
  Jens Jørgen Mortensen authored Sep 26, 2016
  
  e2322482
Sep 23, 2016
- Merge branch 'master' of gitlab.com:ase/ase · 3d535775
  Jens Jørgen Mortensen authored Sep 23, 2016
  
  3d535775
- Finish renaming · 15a28b6b
  Jens Jørgen Mortensen authored Sep 23, 2016
  
  15a28b6b
- Merge branch 'read_old_gpw' into 'master' · 4c3d84ae
  Jens Jørgen Mortensen authored Sep 23, 2016
  4c3d84ae
- fix None.sum() bug · be300ac9
  Mikkel Strange authored Sep 23, 2016
  
  be300ac9
- Merge branch 'fix-duplicate-inertia' into 'master' · 66510f89
  Jens Jørgen Mortensen authored Sep 23, 2016
  66510f89
- Merge branch 'nptdoc' into 'master' · 4861e117
  Jens Jørgen Mortensen authored Sep 23, 2016
  4861e117
Sep 22, 2016
- Merge branch 'write-why-tests-were-skipped' into 'master' · d3d8022e
  Ask Hjorth Larsen authored Sep 22, 2016
  d3d8022e
- handle units correctly when UnitsInput overrides Units · 03d2c6f6
  Ask Hjorth Larsen authored Sep 22, 2016
  
  03d2c6f6
- Correct a wrong method name in documentation of ase.md.npt.NPT. · f32b3458
  Jakob Schiøtz authored Sep 22, 2016
  f32b3458
- when saying that a test is not available, add useful information · 4fc0609f
  Ask Hjorth Larsen authored Sep 22, 2016
  
  4fc0609f
- In the test suite, when a test is skipped, write the reason why that test was skipped · f895c377
  Ask Hjorth Larsen authored Sep 22, 2016
  
  f895c377
- Merge branch 'fix_vasp_xml_test' into 'master' · 5de8cab1
  Eric Hermes authored Sep 22, 2016
  5de8cab1
- Bypass vasp_xml test for Python 2.6 and earlier · 37fca433
  Eric hermes authored Sep 22, 2016
  
  37fca433
- Added proper support for Spacegroup reading from SYMMETRY_OPS · 1e7d10a6
  Simone Sturniolo authored Sep 22, 2016
  
  1e7d10a6
- Added support for generic CASTEP blocks · 6a992eb1
  Simone Sturniolo authored Sep 22, 2016
  
  6a992eb1
Sep 21, 2016
- Merge branch 'vasp_xml_reader_fix' into 'master' · 702f7858
  Eric Hermes authored Sep 21, 2016
  702f7858
- pep8 vasprun.xml reader test · 7ab006ba
  ehermes authored Sep 21, 2016
  
  7ab006ba