Commits · 3.1.0 · Ask Hjorth Larsen / octopus · GitLab

Apr 14, 2009
- Release of Octopus 3.1.0. · fbdce942
  Xavier Andrade authored Apr 14, 2009
  
  View commits for tag 3.1.0 3.1.0
  fbdce942
- Bugfix: some files in share/ were not copied to the build directory. · 8c766835
  Xavier Andrade authored Apr 14, 2009
  
  8c766835
- Created the 3.1.x branch. · d4fae468
  Xavier Andrade authored Apr 14, 2009
  
  d4fae468
- * Changed version to 3.1.0. · 351bd391
  Xavier Andrade authored Apr 14, 2009
  
  351bd391
- Updated the debian scripts. · 679b1b10
  Xavier Andrade authored Apr 14, 2009
  
  679b1b10
- * Added a warning about angular momentum and non-local pseudos. · 64061b24
  Xavier Andrade authored Apr 14, 2009
  64061b24
- Added ChangeLog and PACKAGING files. · 3697293d
  Xavier Andrade authored Apr 14, 2009
  
  3697293d
- Fixed some compiler warnings. · 2ba30cc7
  Xavier Andrade authored Apr 14, 2009
  
  2ba30cc7
- Bugfix: A non-initialized variable. · 54fa2d92
  Xavier Andrade authored Apr 14, 2009
  
  54fa2d92
- Another try at the distcheck problem · f30c7d48
  Miguel Marques authored Apr 14, 2009
  
  f30c7d48
- Xavier, your change deleted some distributed files when performing make... · ba42f506
  Miguel Marques authored Apr 14, 2009
  ba42f506
Apr 13, 2009
- A line was too long. · 2783bf93
  Xavier Andrade authored Apr 13, 2009
  
  2783bf93
- This fixes the problem with make distcheck. · 9bd1ae31
  Xavier Andrade authored Apr 13, 2009
  
  9bd1ae31
- Restricted some parts to developmente version: · b95e186f
  Xavier Andrade authored Apr 13, 2009
  b95e186f
- Removed several unused variables. · fb805a34
  Xavier Andrade authored Apr 13, 2009
  
  fb805a34
- Enabled the casida test in parallel. · dc680e8d
  Xavier Andrade authored Apr 13, 2009
  
  dc680e8d
Apr 12, 2009
- *) Noted in documentation runs that are development-only. · 3dda2dc1
  David Strubbe authored Apr 12, 2009
  3dda2dc1
- *) Reorganized subroutines in em_resp to undo an unnecessary change I made a while ago · 2c23fd5d
  David Strubbe authored Apr 12, 2009
  2c23fd5d
- A few details: · ffb02288
  Alberto Castro authored Apr 12, 2009
  ffb02288
- *) Previous formulation of hyper-Rayleigh scattering (HRS)... · ad348eb3
  David Strubbe authored Apr 12, 2009
  ad348eb3
Apr 11, 2009
- Bugfix: the Biot Savart test did not work in parallel. · bc6e1bfe
  Xavier Andrade authored Apr 11, 2009
  
  bc6e1bfe
- Restricted the (half implemented) Nose-Hoover thermostat to the · ddf9e811
  Xavier Andrade authored Apr 11, 2009
  ddf9e811
- This test has to run as DevelVersion. · 1b9b3e2f
  Xavier Andrade authored Apr 11, 2009
  
  1b9b3e2f
- Sometimes the filter preconditioner gives problems for periodic · 1b361b66
  Xavier Andrade authored Apr 11, 2009
  1b361b66
- Preorthogonalization is only enabled if semiconductor smearing is · fc01e62b
  Xavier Andrade authored Apr 11, 2009
  fc01e62b
- Replaced all checks for conf%devel_version by calls to · 0dd16384
  Xavier Andrade authored Apr 11, 2009
  0dd16384
- Restricted Sternheimer for periodic system to development version. · 7e43041e
  Xavier Andrade authored Apr 11, 2009
  
  7e43041e
- Enabled k point parallelization of the lithium test. · c01d06ca
  Xavier Andrade authored Apr 11, 2009
  
  c01d06ca
- The test files had several fields that are not used so I removed them · a2ebc63c
  Xavier Andrade authored Apr 11, 2009
  a2ebc63c
Apr 10, 2009
- Added a test for parallelization over spin. · 4ac7ac56
  Xavier Andrade authored Apr 10, 2009
  
  4ac7ac56
- * Added the function messages_devel_version to mark code that should · 719227b9
  Xavier Andrade authored Apr 10, 2009
  719227b9
- Bug fix: for lower dimensional cases, the functions were not printed · 9e7e16dc
  Alberto Castro authored Apr 10, 2009
  9e7e16dc
- Restricted parallelization modes for the release: only the ground · 120f5beb
  Xavier Andrade authored Apr 10, 2009
  120f5beb
- Parallelization in k points: now momemtum is allgathered. · 684a1b68
  Xavier Andrade authored Apr 10, 2009
  
  684a1b68
- Bugfix: static arrays should have dimensions known at compilation · 8ba2b903
  Xavier Andrade authored Apr 10, 2009
  8ba2b903
- K point parallelization: Angular momentum information is now · d35af635
  Xavier Andrade authored Apr 10, 2009
  d35af635
Apr 09, 2009
- Tobias' patch: several literals were defined without the proper · 4d0da53b
  Xavier Andrade authored Apr 09, 2009
  4d0da53b
- Wrong filename... · 03b24b1c
  Micael Oliveira authored Apr 09, 2009
  
  03b24b1c
- string_f.h was not included in the distribution, although I'm not sure this... · a24a6eea
  Micael Oliveira authored Apr 09, 2009
  a24a6eea
- Removed a ' from comments. · aa1c68e8
  Xavier Andrade authored Apr 09, 2009
  
  aa1c68e8