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Refactor: merge after_scf (#4889)
Container #2011: Commit c800e28 pushed by mohanchen
August 8, 2024 01:45 37m 58s develop
August 8, 2024 01:45 37m 58s
Fix: avoid the redundant file-reading and remove the useless output i…
Container #2010: Commit afccdb3 pushed by mohanchen
August 8, 2024 01:44 34m 34s develop
August 8, 2024 01:44 34m 34s
Fix: correct the behavior of profile1d function in cube_manipulator.p…
Container #2009: Commit 8421183 pushed by mohanchen
August 8, 2024 01:37 22m 26s develop
August 8, 2024 01:37 22m 26s
fix add_HexxR bug in nspin=4 (#4893)
Container #2008: Commit 52462a7 pushed by mohanchen
August 7, 2024 09:58 38m 21s develop
August 7, 2024 09:58 38m 21s
Refactor: add cal_becp-like example for radial projector-involving …
Container #2007: Commit 58eed06 pushed by mohanchen
August 7, 2024 09:57 35m 8s develop
August 7, 2024 09:57 35m 8s
fix: wrong when use absolute path in STRU (#4881)
Container #2006: Commit 9f55e3a pushed by mohanchen
August 6, 2024 11:38 22m 22s develop
August 6, 2024 11:38 22m 22s
Feature: (for development) support general realspace projection onto …
Container #2005: Commit d2d5c56 pushed by mohanchen
August 5, 2024 13:59 22m 8s develop
August 5, 2024 13:59 22m 8s
Refactor: Add heterogeneous parallel code for the stress loc module. …
Container #2004: Commit d893fda pushed by mohanchen
August 5, 2024 08:50 50m 1s develop
August 5, 2024 08:50 50m 1s
Try I: replace dsytrf & dsytri & gemv by dsysv in Broyden_mixing (#…
Container #2003: Commit 0e2e2c1 pushed by mohanchen
August 5, 2024 08:48 37m 6s develop
August 5, 2024 08:48 37m 6s
Refactor: remove useless values in Hsolverpw (#4875)
Container #2002: Commit 15e4c39 pushed by mohanchen
August 4, 2024 06:57 30m 2s develop
August 4, 2024 06:57 30m 2s
Fix: Incorrect negative signs in length gague RT-TDDFT (#4871)
Container #2001: Commit 40acf87 pushed by mohanchen
August 4, 2024 06:55 22m 8s develop
August 4, 2024 06:55 22m 8s
Fix: reference to parameter instead of global variable in tool functi…
Container #2000: Commit 895c282 pushed by mohanchen
August 3, 2024 12:52 41m 0s develop
August 3, 2024 12:52 41m 0s
Refactor: Replace the pointers in pseudo and Pseudopot_upf with s…
Container #1999: Commit 0f87658 pushed by mohanchen
August 3, 2024 12:49 46m 29s develop
August 3, 2024 12:49 46m 29s
Refactor: remove pes from hsolver (#4861)
Container #1998: Commit 3e6ab1b pushed by mohanchen
August 3, 2024 12:45 45m 18s develop
August 3, 2024 12:45 45m 18s
fix: avoid nan in the output of time percentage (#4857)
Container #1997: Commit 3228e5f pushed by mohanchen
August 3, 2024 12:43 36m 54s develop
August 3, 2024 12:43 36m 54s
discourage part of the use of c-style array in psi initializer (#4866)
Container #1996: Commit 53aa387 pushed by mohanchen
August 2, 2024 08:00 37m 12s develop
August 2, 2024 08:00 37m 12s
Refactor: change the order of initializing member variables (#4865)
Container #1995: Commit 075e4a2 pushed by mohanchen
August 2, 2024 07:41 30m 15s develop
August 2, 2024 07:41 30m 15s
Refactor:Use pointers instead of function calls in OpenMP (#4827)
Container #1994: Commit 5689e8c pushed by mohanchen
August 2, 2024 03:17 55m 16s develop
August 2, 2024 03:17 55m 16s
Feature: enable multi-k calculation for CUDA version of module_gint (…
Container #1993: Commit a83a3b6 pushed by mohanchen
August 1, 2024 08:09 39m 31s develop
August 1, 2024 08:09 39m 31s
Docs: SchmidtOrth in david (#4855)
Container #1992: Commit f7ca386 pushed by mohanchen
August 1, 2024 08:08 39m 38s develop
August 1, 2024 08:08 39m 38s
Refactor: move set_is_occupied func from hsolver to elecstate (#4847)
Container #1991: Commit 880d003 pushed by mohanchen
August 1, 2024 08:08 39m 33s develop
August 1, 2024 08:08 39m 33s
Refactor: remove pelec frome hsolverpw solve func (#4846)
Container #1990: Commit 208a61c pushed by mohanchen
August 1, 2024 04:04 1h 19m 42s develop
August 1, 2024 04:04 1h 19m 42s
Refactor: Use lambda expressions to reduce if conditions. (#4828)
Container #1989: Commit 56faf8f pushed by dyzheng
August 1, 2024 02:26 1h 0m 11s develop
August 1, 2024 02:26 1h 0m 11s
Refactor: Replace Esolver_OF::mu_ with efermi. (#4849)
Container #1988: Commit abaa9ad pushed by mohanchen
August 1, 2024 01:36 41m 17s develop
August 1, 2024 01:36 41m 17s
Feature: Support outputting partial charge densities for different k-…
Container #1987: Commit ef393d8 pushed by mohanchen
August 1, 2024 01:24 43m 45s develop
August 1, 2024 01:24 43m 45s