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usertags
99b43de9
·
modifications to allow user-defined object tags on an atom object that are...
·
Dec 18, 2009
eos
6796294b
·
Move EOS stuff from cmdline branch to eos branch
·
Oct 17, 2011
cmdline
61ab0ba7
·
Ignore blank lines containing whitespace.
·
Oct 17, 2011
vasp
d0e027d8
·
FIX: read CONTCAR if the species list was truncated
·
May 30, 2013
ga
72dbe92b
·
ga: Introduced various sanity checks and improved the documentation.
·
Apr 14, 2014
thermodynamics
5a60edb8
·
Added md and free_energy scripts
·
Aug 06, 2014
d3
51b84a26
·
Merged trunk
·
Aug 22, 2014
py3k
e551c6c5
·
Merge from trunk
·
Feb 03, 2015
trajectory
9af85cd9
·
First rough sketch
·
Feb 03, 2015
idpp
565cc933
·
Version 0.1 ...
·
Feb 05, 2015
embedding
d1c3676b
·
changed readme to include location of associated gpaw branch
·
Jun 12, 2015
castep
1f5e1044
·
Merge from trunk
·
Sep 04, 2015
qmmm
64b115de
·
Allow for PBC in TIP3P
·
Sep 15, 2015
octopus-compatibility-fix
a3989c18
·
cosmetic changes
·
Feb 26, 2016
ase/ase!127
update_translations
c10bec73
·
add Make target to clean translation backups and mo-files
·
Mar 22, 2016
ase/ase!151
rasterize-pb-diagram
f9312fbd
·
rasterize pcolorplot in phase diagram. Allows efficient raster compression...
·
Mar 22, 2016
ase/ase!154
eval-evil
69d4cecd
·
fix randomly noticed bug
·
May 03, 2016
rename-collections
b943175f
·
rename ase.collection to ase.collections. Also, stumbled on a typo where...
·
May 18, 2016
ase/ase!185
io-marvin
4d944266
·
read marvin format (WIP)
·
Sep 07, 2016
jensj/ase-zero-cell
19b47146
·
allow comparisons like Atoms() == None; typo fix
·
Nov 23, 2016
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