Commits · 3b4872d915033f2ecd010693f66f7e304a34c351 · fleur / fleur

13 Feb, 2019 6 commits
- merge · 3b4872d9
  Matthias Redies authored Feb 13, 2019
  
  3b4872d9
- fix comment · 0c68fb7f
  Matthias Redies authored Feb 13, 2019
  
  0c68fb7f
- fix formating · bb5ea022
  Matthias Redies authored Feb 13, 2019
  
  bb5ea022
- fix formating · 0224f05c
  Matthias Redies authored Feb 13, 2019
  
  0224f05c
- added index explainaition · 00bbc78f
  Matthias Redies authored Feb 13, 2019
  
  00bbc78f
- added index explainaition · 16724c92
  Matthias Redies authored Feb 13, 2019
  
  16724c92
12 Feb, 2019 1 commit
- fix factors · badd8b03
  Matthias Redies authored Feb 12, 2019
  
  badd8b03
08 Feb, 2019 4 commits
- remove W=D+7 warning · 117e273a
  Matthias Redies authored Feb 08, 2019
  
  117e273a
- make sure fleur iterates twice in metagga · 2da4d042
  Matthias Redies authored Feb 08, 2019
  
  2da4d042
- remove empty line · a5ee163f
  Matthias Redies authored Feb 08, 2019
  
  a5ee163f
- Merge branch 'develop' into MetaGGA · f9b0a01c
  Matthias Redies authored Feb 08, 2019
  
  f9b0a01c
07 Feb, 2019 7 commits
- Slight cleanup of bfgs* · d47b32ee
  Gregor Michalicek authored Feb 07, 2019
  
  d47b32ee
- remove pw-way. check for negative kED · 9f422347
  Matthias Redies authored Feb 07, 2019
  
  9f422347
- rename this so it compiles · 2ee48ec3
  Matthias Redies authored Feb 07, 2019
  
  2ee48ec3
- apply correction to KS-kinED · d223655c
  Matthias Redies authored Feb 07, 2019
  
  d223655c
- Rotate density matrix using analytically derived expressions (diagonal always real) · 680d0e49
  Gustav Bihlmayer authored Feb 07, 2019
  
  680d0e49
- clean up libxc_postproc · ff6793c4
  Matthias Redies authored Feb 07, 2019
  
  ff6793c4
- save laplace · 3a4ae40d
  Matthias Redies authored Feb 07, 2019
  
  3a4ae40d
06 Feb, 2019 2 commits
- Small bugfix in time module · a6bf96fa
  Daniel Wortmann authored Feb 06, 2019
  
  a6bf96fa
- save current state · 9ed5ac7d
  Matthias Redies authored Feb 06, 2019
  
  9ed5ac7d
05 Feb, 2019 1 commit
- output adjuster for the number of atoms >999 · 6cfb6fab
  Uliana Alekseeva authored Feb 05, 2019
  
  6cfb6fab
04 Feb, 2019 6 commits
- Fix segfault if juDFT_stop is called from inpgen · f12b1f6b
  Gregor Michalicek authored Feb 04, 2019
  
  f12b1f6b
- Merge branch 'develop' into MetaGGA · 3bf5a36c
  Matthias Redies authored Feb 04, 2019
  
  3bf5a36c
- Correct group hierarchy in eig_gw.hdf · 2b91d79b
  Gregor Michalicek authored Feb 04, 2019
```
...it was messed up in one of the last fixes in io/writeBasis.F90
```
  2b91d79b
- Changed sending to isend from ibsend in error handling to avoid buffer overflow... · fbb1330e
  Daniel Wortmann authored Feb 04, 2019
  
  fbb1330e
- Merge branch 'develop' of iffgit.fz-juelich.de:fleur/fleur into develop · 489c0904
  Daniel Wortmann authored Feb 04, 2019
  
  489c0904
- Bugfix for DMI-Forcetheorem and parallel calculations · 3092b242
  Daniel Wortmann authored Feb 04, 2019
  
  3092b242
01 Feb, 2019 13 commits
- Fix wrong array size in abcrot call in io/writeBasis.F90 · bfaea469
  Gregor Michalicek authored Feb 01, 2019
  
  bfaea469
- Another bugfix in io/writeBasis.F90 · f9f135c7
  Gregor Michalicek authored Feb 01, 2019
  
  f9f135c7
- Bugfix for zMat array size in io/writeBasis.F90 · acc6ebf5
  Gregor Michalicek authored Feb 01, 2019
  
  acc6ebf5
- merge develop · 0600854e
  Matthias Redies authored Feb 01, 2019
  
  0600854e
- remove more inf-file stuff · b45986ab
  Matthias Redies authored Feb 01, 2019
  
  b45986ab
- thou shall not break the build-system · e515a89a
  Matthias Redies authored Feb 01, 2019
  
  e515a89a
- nana batman · 9855e05d
  Matthias Redies authored Feb 01, 2019
  
  9855e05d
- Another try to bugfix the commit · 1ec285fb
  Daniel Wortmann authored Feb 01, 2019
  
  1ec285fb
- Another try to bugfix the commit · 818460fd
  Daniel Wortmann authored Feb 01, 2019
  
  818460fd
- Bugfix for last commit · ae386ecf
  Daniel Wortmann authored Feb 01, 2019
  
  ae386ecf
- Removed IO to inf-file (unit=16) · 2981f721
  Daniel Wortmann authored Feb 01, 2019
  
  2981f721
- Merge branch 'develop' of iffgit.fz-juelich.de:fleur/fleur into develop · 9432d20e
  Daniel Wortmann authored Feb 01, 2019
  
  9432d20e
- Removed old gw output. @rost please check if SPEX interface still works :-) · d03bd219
  Daniel Wortmann authored Feb 01, 2019
  
  d03bd219