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gpaw
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Created date
Print msg when symmetry.py finds supercell
gpaw!596
· created
Nov 18, 2019
by
Morten Gjerding
4
updated
Sep 14, 2021
Draft: Use pylibxc
gpaw!635
· created
Feb 19, 2020
by
Jens Jørgen Mortensen
LibXC
1
updated
Oct 03, 2023
ENH: Qinitial
3 of 3 checklist items completed
gpaw!682
· created
Jul 02, 2020
by
Michael Walter
13
updated
Nov 15, 2021
Draft: Beginning of PAW correction for ZFS
gpaw!768
· created
Jan 11, 2021
by
Jens Jørgen Mortensen
updated
May 17, 2023
Draft: Support g basis functions
gpaw!826
· created
Mar 31, 2021
by
Ask Hjorth Larsen
updated
Jul 13, 2021
macOS installation instructions for Wiki
gpaw!830
· created
Apr 07, 2021
by
Toma Susi
Documentation
Installation
43
updated
Oct 12, 2022
Draft: Add noninteracting polarizability for LCAO
gpaw!848
· created
May 06, 2021
by
Tuomas Rossi
1
updated
May 06, 2021
Draft: LCAO dipole/nabla matrix elements
gpaw!857
· created
Jun 02, 2021
by
Ask Hjorth Larsen
2
updated
Jun 14, 2021
Draft_Ehrenfest_MD_lcao
gpaw!878
· created
Jul 01, 2021
by
Vladimir Zobac
2
updated
Aug 04, 2021
Draft: Test PBE implementations
gpaw!923
· created
Aug 20, 2021
by
Jens Jørgen Mortensen
LibXC
Sprint
ready
updated
Sep 13, 2021
Poisson solver with gaussian charges
gpaw!938
· created
Sep 24, 2021
by
Mejdeddine Mokhtar
4
1
updated
Jan 13, 2022
ENH: Print the applied constraints in the positions table of the log
gpaw!944
· created
Oct 07, 2021
by
Georg Kastlunger
22
2
updated
Jan 25, 2024
Draft: Electron-Phonon self energy
2 of 5 checklist items completed
gpaw!956
· created
Nov 01, 2021
by
Robert Warmbier
updated
May 30, 2022
BUG: Fix custom UPF compensation charge
gpaw!959
· created
Nov 03, 2021
by
Juha
6
updated
Dec 21, 2021
Draft: Resolution of identity hybrids to LCAO PAW mode (RI-LVL)
gpaw!962
· created
Nov 11, 2021
by
Mikael Kuisma
updated
Nov 22, 2021
Draft: Add option to discard static external potential in time-propagation TDDFT
gpaw!964
· created
Nov 15, 2021
by
Tuomas Rossi
1
updated
Nov 15, 2021
Fixing downsampling problem
gpaw!967
· created
Nov 18, 2021
by
Mikael Kuisma
1
updated
Oct 03, 2023
Draft: Resolution of Identity Implementation with Projector Augmented Wave Method
gpaw!969
· created
Nov 22, 2021
by
Mikael Kuisma
1
updated
Dec 14, 2021
BSE code ofr magnetic systems wit spin-orbit coupling
gpaw!973
· created
Dec 03, 2021
by
Thomas Olsen
19
updated
Dec 03, 2021
Draft: Ri hybrids
gpaw!1000
· created
Jan 18, 2022
by
Mikael Kuisma
updated
Jan 26, 2022
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