Commits · 786172e7a9e5f31de011c277ad4c18957390a215 · fleur / fleur

14 Jun, 2018 1 commit
- ELPA interface adjusted · 4219fe5e
  Uliana Alekseeva authored Jun 14, 2018
  
  4219fe5e
07 Jun, 2018 1 commit
- git wants me to add main/fleur.F90 although this is not modified · e11f4835
  Miriam Hinzen authored Jun 07, 2018
  
  e11f4835
06 Jun, 2018 1 commit
- Fix bug in eigenvector IO for ChASE program path · 6d4cf118
  Gregor Michalicek authored Jun 06, 2018
```
...together with Miriam Hinzen.
```
  6d4cf118
05 Jun, 2018 1 commit
- Make ChASE inclusion less invasive · 526f9df1
  Gregor Michalicek authored Jun 05, 2018
```
...by turning chase_eig_id into a module variable
```
  526f9df1
04 Jun, 2018 2 commits
- Eliminate the t_zmat type + make ChASE work with eigenvector storage · e76b6605
  Gregor Michalicek authored Jun 04, 2018
  
  e76b6605
- Next step in making ChASE use eigenvectors of the previous iteration · c83ccea4
  Gregor Michalicek authored Jun 04, 2018
```
...together with Miriam Hinzen.
```
  c83ccea4
29 May, 2018 1 commit
- Next step in the implementation of the ChASE program path · 698c9cbd
  Gregor Michalicek authored May 29, 2018
```
...together with Miriam Hinzen.
```
  698c9cbd
26 Feb, 2018 1 commit
- Merge to development branch · da2884ab
  Daniel Wortmann authored Feb 26, 2018
  
  da2884ab
18 Jan, 2018 1 commit
- Added diagonalization switch that does not do any diagonalization but simple... · ecd5cf30
  Daniel Wortmann authored Jan 18, 2018
```
Added diagonalization switch that does not do any diagonalization but simple outputs the matrix for debugging...
```
  ecd5cf30
20 Mar, 2017 1 commit
- Bugfixes found by using gfortran · 2c2994a0
  Daniel Wortmann authored Mar 20, 2017
  
  2c2994a0
01 Mar, 2017 1 commit
- Bugfixes and modifications for PGI compiler/MAGMA · 0e656b09
  Daniel Wortmann authored Mar 01, 2017
  
  0e656b09
09 Feb, 2017 1 commit
- Changes to make the PGI compiler work with FLEUR. Unfortunately · 0b148632
  Daniel Wortmann authored Feb 09, 2017
```
eig-file/data IO is broken and hence the version is not useful yet.
```
  0b148632
26 Jan, 2017 1 commit
- Some fixes in diagonalization part · e5940a5b
  Daniel Wortmann authored Jan 26, 2017
```
apws has to be compiled without optimization on new intel compiler
```
  e5940a5b
16 Jan, 2017 1 commit

Daniel Wortmann authored Jan 16, 2017

- made l_zref a local variable no longer in type sym
- changed the setup of the parallelization (mpi/mpimakegroups is obsolete)
- added new command line switches yet to be documented :-)

894fb095

21 Dec, 2016 1 commit
- Fixed ELPA for version 2016.05.003 · c9f2e983
  Daniel Wortmann authored Dec 21, 2016
  
  c9f2e983
14 Nov, 2016 1 commit
- Bugfixes for juqueen & MPI version · 95185571
  Daniel Wortmann authored Nov 14, 2016
  
  95185571
09 Nov, 2016 1 commit
- Bugfixes for parallel version · 8af7d700
  Daniel Wortmann authored Nov 09, 2016
  
  8af7d700
11 Oct, 2016 1 commit
- Partial introduction of types to encapsulate real/complex arrays · 5c6dc2c0
  Gregor Michalicek authored Oct 11, 2016
  
  5c6dc2c0
07 Oct, 2016 2 commits
- Fixed a bug due optional parameters in franza call in diagonalization/eigen_diag.F90 · eaba0b63
  Gregor Michalicek authored Oct 07, 2016
```
Note that there are much more bugs of this type in diagonalization/eigen_diag.F90.
```
  eaba0b63
- Major change! Should compile but not tested at all yet! · 45b7d160
  Daniel Wortmann authored Oct 07, 2016
```
Removed preprocessor switches CPP_SOC, CPP_INVERSION, CPP_APW, CPP_CORE.
Only a single fleur executable is built.
```
  45b7d160
26 Sep, 2016 1 commit
- Removed lots of preprocessor dependencies, fixed BUG in last commit · fdeca975
  Daniel Wortmann authored Sep 26, 2016
  
  fdeca975
05 Jul, 2016 1 commit
- Added some initialization of variables to allow to run with strict compiler checks · f8fdca37
  Daniel Wortmann authored Jul 05, 2016
  
  f8fdca37
29 Jun, 2016 1 commit
- Added copyright notices to all files in diagonalization subdirectory · 0292b39e
  Gregor Michalicek authored Jun 29, 2016
  
  0292b39e
14 Jun, 2016 2 commits
- Added missing modules for different diagonalization routines · 5c6811f0
  Daniel Wortmann authored Jun 14, 2016
  
  5c6811f0
- Added code to use MAGMA GPU library& makefile support for PGI compiler. Not working yet! · 146c5d6c
  jiff1302 authored Jun 14, 2016
  
  146c5d6c
03 Jun, 2016 1 commit
- Added some Debugging option to write out matrices in parallel case · 8c1f7140
  Daniel Wortmann authored Jun 03, 2016
  
  8c1f7140
24 May, 2016 1 commit
- Fixed Bugs in parallel Version · 5143a617
  Daniel Wortmann authored May 24, 2016
  
  5143a617
26 Apr, 2016 1 commit
- Initial release of FLEUR v0.27 · e15587dc
  Markus Betzinger authored Apr 26, 2016
```
Based on v0.26 hybrid branch
```
  e15587dc