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QEF - Quantum ESPRESSO Foundation
q-e
Merge requests
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21
Merged
2,161
Closed
137
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Created date
Configure for GPUs much simplified
!1714
· created
Jan 16, 2022
by
giannozz
Merged
3
updated
Jan 18, 2022
Enhance the robustness of `install/install_utils` script.
!1713
· created
Jan 15, 2022
by
hongyi-zhao
Merged
9
updated
Jan 22, 2022
Second step towards a better default for parallelization levels
!1712
· created
Jan 13, 2022
by
giannozz
Merged
5
updated
Jan 19, 2022
XSPECTRA bug with k-point parallelization
!1711
· created
Jan 13, 2022
by
giannozz
Merged
updated
Jan 13, 2022
make inside directories broken by reference to a deleted variable
!1710
· created
Jan 13, 2022
by
giannozz
Merged
updated
Jan 13, 2022
[CMake] Add make install in CI.
!1709
· created
Jan 12, 2022
by
Ye Luo
Merged
updated
Jan 12, 2022
replace __OPENACC preprocessor flag with __CUDA && _OPENACC
!1708
· created
Jan 12, 2022
by
Pietro Delugas
Merged
5
updated
Jan 14, 2022
Rename test files in pw_workflow_exx_nscf.
!1707
· created
Jan 12, 2022
by
Ye Luo
Merged
updated
Jan 12, 2022
Band structure interpolation
!1706
· created
Jan 12, 2022
by
Ivan Carnimeo
exx
Merged
updated
Jan 28, 2022
[CMake] fix GGA-noncolin in GPU builds due to miscompliation
!1705
· created
Jan 12, 2022
by
Fabrizio Ferrari
Merged
4
updated
Mar 01, 2022
Misc unrelated changes: DFT-D printout, Cray compilation, removal of phonon developer_man
!1704
· created
Jan 12, 2022
by
giannozz
Merged
8
updated
Jan 12, 2022
Removal of spline interpolation
!1702
· created
Jan 11, 2022
by
giannozz
Merged
updated
Jan 22, 2022
Cleanup of upflib
!1701
· created
Jan 09, 2022
by
giannozz
Merged
updated
Jan 10, 2022
WIP:another step towards automatic choice of parallelization geometry
!1700
· created
Jan 08, 2022
by
giannozz
Merged
updated
Jan 12, 2022
[CMake] Remove HL from hdf5 targets.
!1699
· created
Jan 07, 2022
by
Ye Luo
Merged
updated
Jan 07, 2022
Simplifyng PWgui: "make init" is not needed anymore to use the repository version of PWgui
!1698
· created
Jan 06, 2022
by
Anton Kokalj
Merged
14
updated
Jan 11, 2022
ACE enabled for nscf and bands calculations
!1697
· created
Jan 05, 2022
by
Ivan Carnimeo
exx
Merged
8
updated
May 31, 2022
First steps towards automatic parallelization
!1696
· created
Jan 04, 2022
by
giannozz
Merged
updated
Jan 07, 2022
Added installation of GUI directory
!1695
· created
Jan 04, 2022
by
Daniele Cesarini
Merged
18
updated
Jan 12, 2022
[CMake] Introduce QE_ENABLE_PLUGINS and d3q as submodule
!1694
· created
Jan 01, 2022
by
Ye Luo
Merged
7
Approved
updated
Jan 06, 2022
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