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Updated date
Try to detach windows of gui/reciprocal from the console.
!640
· created
Oct 12, 2017
by
ithod
Closed
7
updated
Oct 31, 2017
Added feature volume on atom to get_volume method
!648
· created
Oct 29, 2017
by
Otto Kohulák
Closed
4
updated
Oct 30, 2017
Add method to recognize that something represents one or more images
!571
· created
Jul 08, 2017
by
Ask Hjorth Larsen
Closed
17
updated
Oct 13, 2017
Test adjusted to new button.
!639
· created
Oct 11, 2017
by
Michael Walter
Closed
2
updated
Oct 12, 2017
Detach guis / fix reciprocal
!632
· created
Oct 09, 2017
by
ithod
Closed
4
updated
Oct 11, 2017
ENH: Add lower triangular form for unit cells
!633
· created
Oct 10, 2017
by
Peter Larsen
Closed
5
updated
Oct 11, 2017
ENH: Atoms.get_spacegroup() method which determines the spacegroup from the Atoms.positions
!300
· created
Oct 06, 2016
by
Emmanuel FARHI
Closed
22
updated
Oct 10, 2017
Test all ase readers
!628
· created
Oct 06, 2017
by
ithod
Closed
7
updated
Oct 09, 2017
Typo fix
!622
· created
Sep 29, 2017
by
Andrew Rosen
Closed
3
updated
Oct 02, 2017
Added Wurtzite B4 structure using GaNFactory
!220
· created
Jul 12, 2016
by
Liam Deacon
Closed
6
updated
Sep 27, 2017
STS functionality to stm.py
!356
· created
Nov 28, 2016
by
Toma Susi
Closed
updated
Sep 25, 2017
ENH: add "print_level" key word in "global" section to ase.calculators.cp2k
!608
· created
Sep 10, 2017
by
Yingchun Zhang
Closed
4
updated
Sep 23, 2017
BUG: Remove constraints before repeating
!606
· created
Sep 07, 2017
by
Michael Walter
Closed
15
updated
Sep 21, 2017
[ENH] cp2k.py: make calculator more tolerant to work with CP2K >= 2.6 and precise potential name
!601
· created
Aug 28, 2017
by
Emmanuel FARHI
Closed
5
1
updated
Sep 08, 2017
[ENH] octopus.py: allow to use ASE_OCTOPUS_COMMAND env var so that e.g. we can use MPI...
!596
· created
Aug 17, 2017
by
Emmanuel FARHI
Closed
3
updated
Aug 18, 2017
WIP: Add hexagonal crystal structure with 60 degrees between the axes
!589
· created
Aug 04, 2017
by
Jens Jørgen Mortensen
Closed
updated
Aug 10, 2017
Preparing for parallel autoneb gpaw test (2nd try)
!578
· created
Jul 13, 2017
by
Esben Leonhard Kolsbjerg
Closed
updated
Jul 13, 2017
Preparing for parallel autoneb gpaw test
!577
· created
Jul 13, 2017
by
Esben Leonhard Kolsbjerg
Closed
updated
Jul 13, 2017
ENH: Add kernel ridge regression module
!350
· created
Nov 22, 2016
by
Mathias Jørgensen
Closed
16
updated
Jun 28, 2017
WIP: Resolve "TST: netcdftrajectory"
!534
· created
Jun 14, 2017
by
Lars Pastewka
Closed
updated
Jun 14, 2017
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