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QEF - Quantum ESPRESSO Foundation
q-e
Merge requests
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21
Merged
2,156
Closed
136
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Popularity
GTH bug
!237
· created
Dec 20, 2018
by
giannozz
Closed
0 of 1 Approvals
0
updated
Dec 20, 2018
WIP: Resolve "Wrong normalization of projector for f-channel of GTH pseudopotentials"
!236
· created
Dec 20, 2018
by
giannozz
Closed
0 of 1 Approvals
0
updated
Dec 20, 2018
WIP: Resolve "HDF5 Feature Request -- Support for Serial HDF5"
!229
· created
Dec 10, 2018
by
Pietro Delugas
feature request
Closed
0 of 1 Approvals
0
updated
Dec 10, 2018
WIP: Resolve "Restarting EXX calculations with increased nqx1,nqx2,nqx3"
!228
· created
Dec 10, 2018
by
Pietro Delugas
feature request
Closed
0 of 1 Approvals
0
updated
Dec 10, 2018
Update a2fmod.f90
!213
· created
Nov 21, 2018
by
Fabrizio Ferrari
Closed
0 of 1 Approvals
0
updated
Nov 21, 2018
Cg implementation
!131
· created
Jul 25, 2018
by
igirotto
Closed
0 of 1 Approvals
0
updated
Jul 26, 2018
Add KLI implementation and examples for the atomic code
!123
· created
Jul 17, 2018
by
Miguel Carvajal
Closed
0 of 1 Approvals
3
updated
Jul 19, 2018
added virtual_v2.f90
!111
· created
Jul 06, 2018
by
Jingyang Wang
Closed
0 of 1 Approvals
13
updated
Aug 29, 2018
Write frequencies and IR intensities and atomic vibrations in Maestro friendly way
!110
· created
Jul 05, 2018
by
afonari
Closed
0 of 1 Approvals
1
updated
Sep 13, 2021
Add vdw_kernels target to the Makefile
!109
· created
Jul 05, 2018
by
afonari
Closed
0 of 1 Approvals
5
updated
Sep 26, 2019
Revert propagation of FFLAGS for FoX
!104
· created
Jun 30, 2018
by
Ye Luo
Closed
0 of 1 Approvals
1
updated
Jun 30, 2018
By default localhost points to IPv6 address on a MacOS and may not work with…
!73
· created
Jun 04, 2018
by
Venkat Kapil
master
Closed
0 of 1 Approvals
5
updated
Jun 05, 2018
Bugfix: declaration of npw variable in pw2wannier90.f90 to make gfortran compiler…
!35
· created
Mar 28, 2018
by
Valerio Vitale
Closed
0 of 1 Approvals
1
updated
Apr 04, 2018
Add procs_io, list of processors belonging to different compute nodes
!28
· created
Mar 13, 2018
by
afonari
master
Closed
0 of 1 Approvals
6
updated
Mar 14, 2023
Fake merge request to check settings
!16
· created
Feb 07, 2018
by
Pietro Delugas
Closed
0 of 1 Approvals
0
updated
Feb 07, 2018
Added 3 options to cell_dofree to allow for epitaxial constraints (2 fixed and 1 free axis)
!12
· created
Feb 02, 2018
by
Uli Aschauer
master
Closed
0 of 1 Approvals
2
updated
Feb 06, 2018
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