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QEF - Quantum ESPRESSO Foundation
q-e
Merge requests
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21
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2,156
Closed
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Created date
on exit punch all must deallocate qexsd_steps
!65
· created
May 16, 2018
by
Pietro Delugas
Merged
updated
May 16, 2018
CP restart with ion_velocities='from_input'
!66
· created
May 21, 2018
by
giannozz
Merged
1
updated
May 27, 2018
Misc changes for compilation and execution on WIndows
!67
· created
May 27, 2018
by
giannozz
Merged
updated
May 27, 2018
Some more cleanup of / and \
!68
· created
May 28, 2018
by
giannozz
Merged
updated
May 28, 2018
Develop
!69
· created
May 28, 2018
by
giannozz
Merged
updated
May 28, 2018
TDDFPT problem with gradient corrections
!70
· created
May 29, 2018
by
giannozz
Merged
updated
May 29, 2018
Update virtual
!71
· created
May 30, 2018
by
Pietro Delugas
Merged
updated
May 30, 2018
Threading the Davidson solver
!72
· created
Jun 03, 2018
by
Ye Luo
Merged
16
updated
Nov 23, 2020
Documentation, i-Pi, celldm updates
!74
· created
Jun 04, 2018
by
giannozz
Merged
updated
Jun 05, 2018
Dump Lowdin charges in a separate file
!75
· created
Jun 05, 2018
by
afonari
Merged
updated
Jun 07, 2018
Memory estimate and report
!76
· created
Jun 08, 2018
by
giannozz
Merged
updated
Jun 08, 2018
update SternheimerGW version number
!77
· created
Jun 08, 2018
by
Martin Schlipf
Merged
updated
Jun 08, 2018
Improve EXX USPP threading and vectorization
!78
· created
Jun 08, 2018
by
Ye Luo
Merged
3
updated
Jun 14, 2018
Correct data layout comment in fft_parallel
!79
· created
Jun 09, 2018
by
Ye Luo
Merged
1
updated
Jun 11, 2018
Improve communication in vexx_k
!80
· created
Jun 10, 2018
by
Ye Luo
Merged
updated
Jun 18, 2018
Disable automatic selection of XML format of dynamical matrix when using non-colinear magnetization
!81
· created
Jun 11, 2018
by
Lorenzo Paulatto
Merged
updated
Jun 11, 2018
Adding support for RVV10+SCAN functional (and any metaGGA+VDW in general)
!82
· created
Jun 11, 2018
by
Lorenzo Paulatto
Merged
1
updated
Jun 12, 2018
TDDFPT+USPP with k-points (turbo_lanczos.x) is not fully implemented.
!83
· created
Jun 12, 2018
by
Iurii Timrov
Merged
updated
Jun 13, 2018
fix import of nspin=2 density file to nspin=4
!84
· created
Jun 13, 2018
by
Pietro Delugas
Merged
updated
Jun 13, 2018
cpu time per mpi task scaled dow by the number of omp processes participating into it
!85
· created
Jun 13, 2018
by
Stefano de Gironcoli
Merged
1
updated
Jun 23, 2018
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