Commits · afc94aa4f9a8826fa158778e189402d8782145c0 · RelaxSE / RelaxSE-Code

May 05, 2022
- Merge branch 'master' into dev/prop · afc94aa4
  Elisa Rebolini authored 2 years ago
  
  afc94aa4
May 04, 2022
- Remove prop test for intel as binaries were generated with gnu · 4fc77b78
  Elisa Rebolini authored 2 years ago
  
  4fc77b78
- Implementation of the density matrix · 7ac31baf
  Elisa Rebolini authored 2 years ago
  
  Serial and OMP version
  7ac31baf
- Implementation of the density matrix · 7fe7f4c8
  Elisa Rebolini authored 2 years ago
  
  Serial and OMP version
  7fe7f4c8
Apr 29, 2022
- derniere correction etait une erreur : remise en l'etat · 714f713e
  Marie bernadette Lepetit authored 2 years ago
  
  714f713e
Apr 28, 2022
- erreur ecriture op. Fock corrigee : ordre c-> fortran · 63d12423
  Marie bernadette Lepetit authored 2 years ago
  
  63d12423
Apr 26, 2022
- mise à jour du manuel sur prop · dd087d8b
  Marie bernadette Lepetit authored 2 years ago
  
  dd087d8b
- print conf with large coef in WF · 311197bf
  Marie bernadette Lepetit authored 2 years ago
  
  311197bf
Apr 11, 2022
- Mise à jour des tests · c7b8a7e8
  Marie bernadette Lepetit authored 2 years ago
  
  c7b8a7e8
Mar 10, 2022
- update tests · 2e6b5ad4
  Elisa Rebolini authored 3 years ago
  
  2e6b5ad4
Mar 03, 2022
- Merge branch 'dev/prop' of https://code.ill.fr/relaxse/relaxse-code into dev/prop · 062d5c2e
  Marie bernadette Lepetit authored 3 years ago
  
  062d5c2e
- Error in input reading for prop in CAS case · 845ae985
  Marie bernadette Lepetit authored 3 years ago
  
  845ae985
- Error in input reading for prop in CAS case · a9d8948e
  Marie bernadette Lepetit authored 3 years ago
  
  a9d8948e
- ecrituresé · edcdf5e3
  Marie bernadette Lepetit authored 3 years ago
  
  git commit -a -m ecritures
  edcdf5e3
Mar 02, 2022
- tighten print threshold prop test · d407c735
  Elisa Rebolini authored 3 years ago
  
  d407c735
- remove the longer tests · c77d1d28
  Elisa Rebolini authored 3 years ago
  
  c77d1d28
- test prop · 268a318e
  Elisa Rebolini authored 3 years ago
  
  268a318e
- test prop · d599f6d7
  Elisa Rebolini authored 3 years ago
  
  d599f6d7
Mar 01, 2022
- change prop CuO_02204 to use always the same input files · 60037c88
  Elisa Rebolini authored 3 years ago
  
  60037c88
- remove goto in prop for omp debug · 48186235
  Elisa Rebolini authored 3 years ago
  
  48186235
- Merge branch 'dev/prop' of https://code.ill.fr/relaxse/relaxse-code into dev/prop · 0e9d5a4a
  Marie bernadette Lepetit authored 3 years ago
  
  0e9d5a4a
Feb 28, 2022
- update propout test results · df04d1de
  Elisa Rebolini authored 3 years ago
  
  df04d1de
- add some extra test for prop omp · 99a76ff6
  Elisa Rebolini authored 3 years ago
  
  99a76ff6
Feb 16, 2022
- update cmake languages in project · 48cc423a
  Elisa Rebolini authored 3 years ago
  
  48cc423a
Feb 04, 2022
- tigthen test prop · 3f74c873
  Elisa Rebolini authored 3 years ago
  
  3f74c873
- details ds tests · 9d431969
  Marie bernadette Lepetit authored 3 years ago
  
  9d431969
- update test sans omp · c42c6285
  Elisa Rebolini authored 3 years ago
  
  c42c6285
Feb 02, 2022
- Merge branch 'depot' into 'master' · 9fcd48c5
  Elisa Rebolini authored 3 years ago
  
  clean up depot APP See merge request !3
  9fcd48c5
- test prop · 94285bc1
  Elisa Rebolini authored 3 years ago
  
  94285bc1
Jan 18, 2022
- erreur ref0 corrigee · b7104bfd
  Marie bernadette Lepetit authored 3 years ago
  
  b7104bfd
- erreur ds 00440 · 743644d5
  Marie bernadette Lepetit authored 3 years ago
  
  743644d5
Nov 17, 2021
- fermeture des det etc d'elisa · 40518fd5
  Marie bernadette Lepetit authored 3 years ago
  
  40518fd5
- test 03405 · e5c4667d
  Marie bernadette Lepetit authored 3 years ago
  
  e5c4667d
Oct 28, 2021
- CuO_30450/ · 0618dbd0
  Marie bernadette Lepetit authored 3 years ago
  
  0618dbd0
Oct 19, 2021
- clean up depot APP · 9020013e
  Elisa Rebolini authored 3 years ago
  
  9020013e
Sep 16, 2021
- correction erreur introduite dans code genere · e64c5a04
  Marie bernadette Lepetit authored 3 years ago
  
  e64c5a04
Jul 23, 2021
- termes diagonaux semblent OK - prog verif · 5862f8bc
  Marie bernadette Lepetit authored 3 years ago
  
  5862f8bc
Jul 21, 2021
- Merge branch 'dev/prop' of https://code.ill.fr/relaxse/relaxse-code into dev/prop · ad1a6aed
  Marie bernadette Lepetit authored 3 years ago
  
  ad1a6aed
- dens dans le cas semble marcher mais doit etre verifiee plus avant · 403f611f
  Marie bernadette Lepetit authored 3 years ago
  
  403f611f
- add some extra comments on type(connect) · 897edfb6
  Elisa Rebolini authored 3 years ago
  
  897edfb6