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QEF - Quantum ESPRESSO Foundation
q-e
Merge requests
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21
Merged
2,160
Closed
136
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Label priority
Fix compilation failure caused by !1616
!1631
· created
Nov 15, 2021
by
Ye Luo
bug
high-priority
Merged
Approved
updated
Nov 15, 2021
Draft: Final (?) changes to interpolation tables
!2341
· created
Apr 24, 2024
by
giannozz
0 of 1 Approvals
updated
Apr 24, 2024
PAW xc potential fully ported with openACC
!2340
· created
Apr 24, 2024
by
Fabrizio Ferrari
3
0 of 1 Approvals
updated
Apr 24, 2024
Small change improving GPU+DFT+U+USPP performance of stress calculation
!2339
· created
Apr 23, 2024
by
giannozz
Merged
Approved
updated
Apr 23, 2024
INPUT_OSCDFT.def: typo -- wrong variable name "print_debug"; must be "debug_print"
!2338
· created
Apr 23, 2024
by
Anton Kokalj
Merged
Approved
updated
Apr 23, 2024
Fix for lda+U force ad stress with OpenAcc
!2337
· created
Apr 19, 2024
by
Janusz Andrzejewski
Merged
10
Approved
updated
Apr 20, 2024
Ooops ....
!2336
· created
Apr 18, 2024
by
giannozz
Merged
1
Approved
updated
Apr 19, 2024
Draft: adddvhubscf: ZGEMM implementation
!2335
· created
Apr 18, 2024
by
Janusz Andrzejewski
0 of 1 Approvals
updated
Apr 18, 2024
Some more tweakings to atomic wavefunctions
!2334
· created
Apr 18, 2024
by
giannozz
Merged
1
Approved
updated
Apr 18, 2024
FFTXlib: fix mpi_wait to use mpi fortran modules
!2333
· created
Apr 18, 2024
by
Janusz Andrzejewski
3
0 of 1 Approvals
updated
Apr 24, 2024
HP: ZGEMM implementation without conjugation of proj1 and proj2 matrices
!2332
· created
Apr 18, 2024
by
Janusz Andrzejewski
Merged
Approved
updated
Apr 18, 2024
Draft: Reorder charge density components
!2331
· created
Apr 18, 2024
by
giannozz
0 of 1 Approvals
updated
Apr 18, 2024
Missing (-1)^l factor in atomic wavefunctions
!2330
· created
Apr 16, 2024
by
giannozz
Merged
Approved
updated
Apr 17, 2024
[OpenMP] Less use of array reduction
!2329
· created
Apr 16, 2024
by
Ye Luo
Merged
1
Approved
updated
Apr 16, 2024
Draft: Develop
!2328
· created
Apr 16, 2024
by
Ashkan Shekaari
Closed
1
0 of 1 Approvals
updated
Apr 16, 2024
HP - implement ZGEMM lapack subroutine
!2327
· created
Apr 16, 2024
by
Janusz Andrzejewski
Closed
10
Approved
updated
Apr 18, 2024
Pre-final changes to atomic wavefunction code
!2326
· created
Apr 14, 2024
by
giannozz
Merged
Approved
updated
Apr 15, 2024
New new schema things
!2325
· created
Apr 11, 2024
by
Pietro Delugas
Merged
Approved
updated
Apr 12, 2024
NEB+U+V
!2324
· created
Apr 11, 2024
by
Iurii Timrov
Merged
Approved
updated
Apr 12, 2024
New schema things
!2323
· created
Apr 10, 2024
by
Pietro Delugas
Merged
Approved
updated
Apr 10, 2024
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