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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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Label priority
bugfix out-of-bound err HP - 2nd attempt
!2218
· created
Jan 06, 2024
by
Luca Binci
Merged
Approved
updated
Jan 07, 2024
2D cutoff with Gamma trick
!2217
· created
Jan 05, 2024
by
giannozz
Merged
Approved
updated
Jan 06, 2024
Missing DFT+u case in sum_band_gpu - fixes issue #630
!2216
· created
Jan 05, 2024
by
giannozz
Merged
Approved
updated
Jan 06, 2024
More explicit error message for too few bands in the noncolin case in PW/setup.f90
!2215
· created
Jan 05, 2024
by
afonari
Merged
Approved
updated
Jan 06, 2024
Fix out-of-bound errors in HP
!2214
· created
Jan 05, 2024
by
Luca Binci
Merged
Approved
updated
Jan 05, 2024
Yet another problem with broadcast of zero-sized array. Fixes #633
!2213
· created
Jan 04, 2024
by
giannozz
Merged
Approved
updated
Jan 04, 2024
More tab_beta cleanup
!2212
· created
Jan 02, 2024
by
giannozz
Merged
Approved
updated
Jan 05, 2024
More tab_beta cleanup
!2211
· created
Jan 02, 2024
by
giannozz
Closed
0 of 1 Approvals
updated
Jan 02, 2024
Draft: More tab beta cleanup
!2210
· created
Jan 02, 2024
by
giannozz
Closed
0 of 1 Approvals
updated
Jan 02, 2024
Fix upper boundaries of psi and hpsi in pcegterg_gpu for cpu-distributed diag
!2209
· created
Dec 29, 2023
by
Laura Bellentani
Merged
2
Approved
updated
Dec 29, 2023
pw2wannier90: Fix a bug in compute_uHu and compute_sHu with DFT+U
!2208
· created
Dec 23, 2023
by
Jae-Mo Lihm
Merged
1
Approved
updated
Dec 31, 2023
Hubbard with omp5
!2207
· created
Dec 22, 2023
by
Oscar
develop_omp5
Merged
Approved
updated
Jan 02, 2024
Move from non-standard target variant dispatch to standard dispatch construct for MKL calls
!2206
· created
Dec 21, 2023
by
Giacomo Rossi
develop_omp5
Merged
Approved
updated
Jan 11, 2024
[skip-CI] Fix for f channel of GTH PP
!2205
· created
Dec 18, 2023
by
giannozz
Merged
Approved
updated
Dec 18, 2023
merge update develop to master for qe-7.3
!2204
· created
Dec 15, 2023
by
Pietro Delugas
master
Merged
Approved
updated
Dec 15, 2023
forgotten version update in CMake
!2203
· created
Dec 15, 2023
by
Pietro Delugas
Merged
Approved
updated
Dec 15, 2023
merge develop into master for release qe-7.3
!2202
· created
Dec 15, 2023
by
Pietro Delugas
master
Merged
Approved
updated
Dec 15, 2023
chore: update version headers
!2201
· created
Dec 15, 2023
by
Pietro Delugas
Merged
1
Approved
updated
Dec 15, 2023
Various improvements for pw2wannier90
!2200
· created
Dec 13, 2023
by
Junfeng Qiao
Merged
1
1
Approved
updated
Dec 18, 2023
Align develop_omp5 to the official develop branch and use the new calbec interfaces with OMP5 offload
!2199
· created
Dec 13, 2023
by
Ivan Carnimeo
develop_omp5
Merged
Approved
updated
Dec 14, 2023
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