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QEF - Quantum ESPRESSO Foundation
q-e
Merge requests
Open
20
Merged
2,172
Closed
137
All
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Milestone due date
Incorrect PP_SEMILOCAL written to UPF v.2
!2081
· created
May 11, 2023
by
giannozz
Merged
updated
May 12, 2023
Add CMake customization for the Cray Fortran compiler
!2080
· created
May 09, 2023
by
Ye Luo
Merged
updated
May 10, 2023
[skip-CI] Unclosed file was causing trouble with GTH pseudopotential reading
!2079
· created
Apr 29, 2023
by
giannozz
Merged
updated
Apr 29, 2023
More upf cleanup
!2078
· created
Apr 25, 2023
by
giannozz
Merged
updated
Apr 28, 2023
Unix exit status of pw.x
!2077
· created
Apr 20, 2023
by
giannozz
Merged
3
updated
Apr 25, 2023
[skip-CI] Fix for issue #582
!2076
· created
Apr 19, 2023
by
giannozz
Merged
updated
Apr 20, 2023
upf%nn removed also here
!2075
· created
Apr 18, 2023
by
giannozz
Merged
updated
Apr 18, 2023
Some more upf clean-up, notably in error handling
!2074
· created
Apr 18, 2023
by
giannozz
Merged
updated
Apr 20, 2023
fix hp
!2073
· created
Apr 18, 2023
by
Ivan Carnimeo
Merged
updated
Apr 18, 2023
Remove redundant variable from upf type
!2072
· created
Apr 17, 2023
by
giannozz
Merged
updated
Apr 18, 2023
[skip-CI] Small documentation and error message improvements for case "vcut"
!2071
· created
Apr 17, 2023
by
giannozz
Merged
updated
Apr 17, 2023
PSML to UPF converter
!2070
· created
Apr 17, 2023
by
giannozz
Merged
updated
Apr 17, 2023
[skip-CI] Recent change produced a bogus error on some UPF files
!2069
· created
Apr 14, 2023
by
giannozz
Merged
updated
Apr 14, 2023
UPF cleanup and improvements
!2068
· created
Apr 12, 2023
by
giannozz
Merged
updated
Apr 13, 2023
[skip-CI] Add test for upf PP
!2067
· created
Apr 07, 2023
by
giannozz
Merged
updated
Apr 12, 2023
[skip-CI] Small fixes
!2066
· created
Apr 07, 2023
by
giannozz
Merged
updated
Apr 07, 2023
[skip-CI] enable-scalapack-qrcp was not working
!2065
· created
Apr 04, 2023
by
giannozz
Merged
updated
Apr 04, 2023
[QEHeat] fixes #579
!2064
· created
Apr 04, 2023
by
Riccardo Bertossa
Merged
2
updated
Apr 06, 2023
[Bug Fix, PW] Cholesky Error in Hybrid DFT Calculation When Using ACE
!2063
· created
Apr 03, 2023
by
Ju-an Zhang
Merged
8
Approved
updated
Aug 01, 2023
a couple of things rewritten from CUF to ACC
!2062
· created
Apr 03, 2023
by
Ivan Carnimeo
gpu
Merged
updated
Apr 18, 2023
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