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QEF - Quantum ESPRESSO Foundation
q-e
Merge requests
Open
18
Merged
2,181
Closed
138
All
2,337
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Updated date
Improve communication in vexx_k
!80
· created
Jun 10, 2018
by
Ye Luo
Merged
updated
Jun 18, 2018
Update manual about DFTI vs FFTW3 with MKL
!92
· created
Jun 18, 2018
by
Ye Luo
Merged
updated
Jun 18, 2018
Some improvements to the XDM module and small cleanup
!90
· created
Jun 15, 2018
by
Alberto Otero de la Roza
Merged
updated
Jun 16, 2018
Minor tests and configure tweaking
!89
· created
Jun 15, 2018
by
giannozz
Merged
updated
Jun 15, 2018
Bugfix: Need to protect the array range properly.
!88
· created
Jun 14, 2018
by
Ye Luo
Merged
updated
Jun 15, 2018
Avoid filling ptmp zero in hpsi_dot_v of cegterg.
!32
· created
Mar 18, 2018
by
Ye Luo
Merged
4
updated
Jun 14, 2018
Improve EXX USPP threading and vectorization
!78
· created
Jun 08, 2018
by
Ye Luo
Merged
3
updated
Jun 14, 2018
EPA method
!86
· created
Jun 13, 2018
by
Georgy Samsonidze
Merged
4
updated
Jun 14, 2018
Minor things, small bug in dos.x
!87
· created
Jun 14, 2018
by
giannozz
Merged
updated
Jun 14, 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
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
Correct data layout comment in fft_parallel
!79
· created
Jun 09, 2018
by
Ye Luo
Merged
1
updated
Jun 11, 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
update SternheimerGW version number
!77
· created
Jun 08, 2018
by
Martin Schlipf
Merged
updated
Jun 08, 2018
Memory estimate and report
!76
· created
Jun 08, 2018
by
giannozz
Merged
updated
Jun 08, 2018
Dump Lowdin charges in a separate file
!75
· created
Jun 05, 2018
by
afonari
Merged
updated
Jun 07, 2018
Documentation, i-Pi, celldm updates
!74
· created
Jun 04, 2018
by
giannozz
Merged
updated
Jun 05, 2018
Improve the threading of paralllel 3D FFT
!61
· created
May 10, 2018
by
Ye Luo
Merged
updated
Jun 01, 2018
Update virtual
!71
· created
May 30, 2018
by
Pietro Delugas
Merged
updated
May 30, 2018
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