Commits · 25a1698595490f0396da19665f001f738b76762f · myron / ab2tds

Mar 16, 2016
- adapted tds2el harvesting to trigonals cells · 25a16985
  Alessandro Mirone authored 9 years ago
  
  25a16985
Feb 04, 2016
- corrected some rst documentation strings · 92e52d93
  Alessandro Mirone authored 9 years ago
  
  92e52d93
- added documentation for CODE reading parameter · 43fe4274
  Alessandro Mirone authored 9 years ago
  
  43fe4274
- Merge git.epn-campus.eu:ab2tds · 2d53f597
  Alessandro Mirone authored 9 years ago
  
  2d53f597
- added doc · 6159c49c
  Bjoern Wehinger authored 9 years ago
  
  6159c49c
- changed naming of vasp format · 688d786b
  Alessandro Mirone authored 9 years ago
  
  688d786b
Sep 07, 2015
- to be pushed on repository · 0f37e99f
  Alessandro Mirone authored 9 years ago
  
  0f37e99f
Sep 01, 2015
- rimosso il blocco della dipendenza · 053b6bc0
  Alessandro Mirone authored 9 years ago
  
  053b6bc0
Aug 31, 2015
- quasi pronto per produzione : rimane da introdurre un dipendenza in tds2el · ae6fe5b0
  Alessandro MIRONE authored 9 years ago
  
  ae6fe5b0
Aug 29, 2015
- rimesso in forma per generare collection con tanto di dw e scatts · 27c2b8f8
  Alessandro MIRONE authored 9 years ago
  
  27c2b8f8
Aug 28, 2015
- rimesso in forma per fittare intensity senza DW e scatts · f398f5af
  Alessandro MIRONE authored 9 years ago
  
  f398f5af
- messo in commento parte che verifica quadracita · 05af089d
  Alessandro MIRONE authored 9 years ago
  
  05af089d
Aug 25, 2015
- quesi perfetto con intensita senza DW e scatt facts · e80fef48
  Alessandro MIRONE authored 9 years ago
  
  e80fef48
Aug 20, 2015
- collections presque OK. Ajoute a git le script pour makeElasticTensor. Corrige un prob hdf5 · 72ea4108
  Alessandro MIRONE authored 9 years ago
  
  72ea4108
Aug 11, 2015
- funziona · cf047b1a
  Alessandro MIRONE authored 9 years ago
  
  cf047b1a
- finito · 5d6902a7
  Alessandro MIRONE authored 9 years ago
  
  5d6902a7
Aug 10, 2015
- metti pure a zero i restanti di loadharvestfromfile eccetto qmax, da mettere senza 2pi · d2c5b569
  Alessandro MIRONE authored 9 years ago
  
  d2c5b569
Aug 07, 2015
- calcolate intensita per havest. Adesso ritrascriverle · b3970d73
  Alessandro MIRONE authored 9 years ago
  
  b3970d73
May 05, 2015
- ca devrait etre bon · 66ced1df
  Alessandro Mirone authored 9 years ago
  
  66ced1df
- petite correction · 9c20fd2f
  Alessandro Mirone authored 9 years ago
  
  9c20fd2f
- charge de Born et Polarization 9 dielectique ) de Vasp · 9b35058a
  Alessandro Mirone authored 9 years ago
  
  9b35058a
- derniere retouche · 0ae8380e
  Alessandro Mirone authored 9 years ago
  
  0ae8380e
Apr 28, 2015
- trying to correct phases for vasp · 6a5e7817
  Alessandro Mirone authored 9 years ago
  
  6a5e7817
Apr 24, 2015
- fixed better the unit factors for Vasp · 310d545e
  Alessandro Mirone authored 9 years ago
  
  310d545e
Apr 22, 2015
- Merge branch 'correction_hdf5' · c4c02be2
  myron authored 9 years ago
  
  Conflicts: ab2tds/TDS_Simmetry.py
  c4c02be2
Apr 21, 2015
- corrected some problem, also with h5py · 8334ade9
  myron authored 9 years ago
  
  8334ade9
- works till reduced_positions which must be set in input file · 2592e1c3
  myron authored 9 years ago
  
  2592e1c3
- written reading from vasp · d40f23c2
  myron authored 9 years ago
  
  d40f23c2
Feb 05, 2015
- merged with the last vesion · 1d4741fe
  Thomas Forrest authored 10 years ago
  
  Merge branch 'master' of git://forge.epn-campus.eu/repositories/ab2tds
  1d4741fe
- adapted to PyMca5 layout · c0f44ed2
  Thomas Forrest authored 10 years ago
  
  c0f44ed2
Nov 13, 2014
- choses qui manqueaient pout PyMca · bce5f23d
  Alessandro Mirone authored 10 years ago
  
  bce5f23d
- corrected hdf5 bugs · 9366776f
  Alessandro Mirone authored 10 years ago
  
  9366776f
Nov 12, 2014
- problema PyMca · 47342f81
  Alessandro Mirone authored 10 years ago
  
  47342f81
- clean output · e9f66bec
  Bjoern Wehinger authored 10 years ago
  
  e9f66bec
Oct 23, 2014
- removed pre-normalisation · 22652847
  Alessandro Mirone authored 10 years ago
  
  22652847
- corrected the factors · df1b8c50
  Alessandro Mirone authored 10 years ago
  
  df1b8c50
- trying to output absolute values · 699ab0c3
  Alessandro Mirone authored 10 years ago
  
  699ab0c3
Oct 20, 2014
- ca commence a marcher le fit du tenseur · d357f08e
  Alessandro Mirone authored 10 years ago
  
  d357f08e
Oct 02, 2014
- finito di scrivere il fit delle costanti elastiche · 09f8a8df
  Alessandro Mirone authored 10 years ago
  
  09f8a8df
May 16, 2014
- petite correction · 1e174a7a
  Alessandro Mirone authored 10 years ago
  
  1e174a7a