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QEF - Quantum ESPRESSO Foundation
q-e
Merge requests
Open
20
Merged
2,162
Closed
137
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Milestone due date
[skip-CI] Better initial seed for random number sequences
!2137
· created
Aug 25, 2023
by
giannozz
Merged
Approved
updated
Aug 26, 2023
fix: fix typo in x_ac_qe_fft
!2136
· created
Aug 23, 2023
by
Pietro Delugas
Merged
Approved
updated
Aug 25, 2023
CMake updated to reflect recent changes in pw2wannier
!2135
· created
Aug 11, 2023
by
giannozz
Merged
Approved
updated
Aug 11, 2023
[skip-CI] Temporarily remove check on EXX stress
!2134
· created
Aug 11, 2023
by
giannozz
Merged
Approved
updated
Aug 11, 2023
Refold atoms around the origin before computing DFT-D3 energies and forces
!2133
· created
Aug 11, 2023
by
giannozz
Merged
Approved
updated
Sep 15, 2023
[skip-CI] Yet another bogus UPF v.1 error
!2132
· created
Aug 11, 2023
by
giannozz
Merged
Approved
updated
Aug 11, 2023
Random numbers in MD
!2131
· created
Aug 10, 2023
by
giannozz
Merged
Approved
updated
Aug 11, 2023
Strange berry-phase problem with empty bands
!2130
· created
Aug 10, 2023
by
giannozz
Merged
Approved
updated
Aug 11, 2023
[skip-CI] Print units of generated k-points
!2129
· created
Aug 08, 2023
by
giannozz
Merged
Approved
updated
Aug 11, 2023
[skip-CI] Misspelled variable and incorrect test, courtesy Daniel Kirsten
!2128
· created
Aug 08, 2023
by
giannozz
Merged
Approved
updated
Aug 08, 2023
workflow to automatically sync github repository with gitlab
!2127
· created
Aug 08, 2023
by
Pranab Das
Closed
1
0 of 1 Approvals
updated
Aug 11, 2023
Add projectability-disentangled Wannier functions to pw2wannier90
!2126
· created
Jul 13, 2023
by
Junfeng Qiao
Merged
3
Approved
updated
Dec 13, 2023
Draft: libxc in test-suite
!2125
· created
Jul 13, 2023
by
Fabrizio Ferrari
0 of 1 Approvals
updated
Jul 13, 2023
Update release-notes
!2124
· created
Jul 12, 2023
by
Fabrizio Ferrari
Merged
Approved
updated
Jul 13, 2023
libxc_gga_fix (v7.2)
!2123
· created
Jul 11, 2023
by
Fabrizio Ferrari
Merged
3
Approved
updated
Jul 12, 2023
Updating QE 7.2 interface for EPIq
!2122
· created
Jul 07, 2023
by
Guglielmo Marchese
Merged
2
Approved
updated
Jul 13, 2023
CI on GitLab fails because it uses a too old compiler ... workaround
!2121
· created
Jul 06, 2023
by
giannozz
Merged
Approved
updated
Jul 07, 2023
fix: acc kernels clause with if inside
!2120
· created
Jul 06, 2023
by
Pietro Delugas
Merged
Approved
updated
Jul 10, 2023
[skip-CI] Fix dumb problem with I/O
!2119
· created
Jul 05, 2023
by
giannozz
Merged
Approved
updated
Jul 11, 2023
[skip-CI] There is something very wrong in the stres with exact exchange
!2118
· created
Jul 03, 2023
by
giannozz
Merged
3
Approved
updated
Jul 05, 2023
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