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fixing the sigma value in example input files and adding comments to …
Doxygen Documentation Deployment #553: Commit 4835dd0 pushed by mohanchen
November 12, 2024 03:36 9m 10s develop
November 12, 2024 03:36 9m 10s
Refactor: runner() of esolver_ks (#5445)
Doxygen Documentation Deployment #552: Commit c03c879 pushed by mohanchen
November 11, 2024 08:33 23m 15s develop
November 11, 2024 08:33 23m 15s
fix dsygvx (#5443)
Doxygen Documentation Deployment #551: Commit 32ba8d4 pushed by mohanchen
November 10, 2024 02:54 8m 33s develop
November 10, 2024 02:54 8m 33s
Fix blas_connector.cpp warnings and math_kernel_op.cu warnings (#5444)
Doxygen Documentation Deployment #550: Commit cead7ce pushed by mohanchen
November 8, 2024 17:22 3m 41s develop
November 8, 2024 17:22 3m 41s
fix the conficit between mixing_restart and scf_os_stop (#5440)
Doxygen Documentation Deployment #549: Commit b63aad4 pushed by dyzheng
November 8, 2024 08:34 34m 29s develop
November 8, 2024 08:34 34m 29s
Fix: potential segmentation fault in DFTU force&stress (#5439)
Doxygen Documentation Deployment #548: Commit 2d3bf57 pushed by WHUweiqingzhou
November 8, 2024 07:32 3m 43s develop
November 8, 2024 07:32 3m 43s
Feature:Now sDFT support GPU (#5423)
Doxygen Documentation Deployment #547: Commit 7da86cd pushed by mohanchen
November 7, 2024 14:24 1h 10m 7s develop
November 7, 2024 14:24 1h 10m 7s
Integration test: Rename folders for consistency with get_pchg and …
Doxygen Documentation Deployment #546: Commit 83efe85 pushed by mohanchen
November 7, 2024 14:20 3m 57s develop
November 7, 2024 14:20 3m 57s
Feature: add interface Gint::psir_func (#5380)
Doxygen Documentation Deployment #545: Commit 3da2868 pushed by mohanchen
November 7, 2024 14:19 1m 11s develop
November 7, 2024 14:19 1m 11s
Remove git submodule LibRI and LibComm (#5428)
Doxygen Documentation Deployment #544: Commit 01beb19 pushed by mohanchen
November 7, 2024 14:15 3m 41s develop
November 7, 2024 14:15 3m 41s
Fix&Refactor: soc force/stress error for LCAO code, refactor the forc…
Doxygen Documentation Deployment #543: Commit 502fdec pushed by mohanchen
November 7, 2024 07:08 54m 4s develop
November 7, 2024 07:08 54m 4s
Refactor: refactor iter_finish and iter_init (#5426)
Doxygen Documentation Deployment #542: Commit d81cb46 pushed by mohanchen
November 7, 2024 07:01 6m 55s develop
November 7, 2024 07:01 6m 55s
Feature: enable ABACUS can finish SCF if charge density oscillation i…
Doxygen Documentation Deployment #541: Commit 0d455cb pushed by WHUweiqingzhou
November 7, 2024 02:08 3m 36s develop
November 7, 2024 02:08 3m 36s
Refactor: modify EXX realx/md calculation framework (#5403)
Doxygen Documentation Deployment #540: Commit cc9d759 pushed by mohanchen
November 6, 2024 14:37 10m 4s develop
November 6, 2024 14:37 10m 4s
Fix: update the example of vdwd3 acoording to the latest impl. (#5418)
Doxygen Documentation Deployment #539: Commit d533ad5 pushed by mohanchen
November 6, 2024 14:36 1m 33s develop
November 6, 2024 14:36 1m 33s
Refactor: remove useless functions in esolver (#5416)
Doxygen Documentation Deployment #538: Commit dd862ea pushed by YuLiu98
November 6, 2024 09:04 3m 35s develop
November 6, 2024 09:04 3m 35s
wrap exx-routine in iter_finish (#5413)
Doxygen Documentation Deployment #537: Commit 27075c1 pushed by mohanchen
November 6, 2024 03:22 30m 26s develop
November 6, 2024 03:22 30m 26s
Fix: not build useless library without ENABLE_LCAO (#5412)
Doxygen Documentation Deployment #536: Commit efd8594 pushed by mohanchen
November 6, 2024 03:18 3m 55s develop
November 6, 2024 03:18 3m 55s
Feature: build-in DFTD3 parameters (#5378)
Doxygen Documentation Deployment #535: Commit edfa4c1 pushed by mohanchen
November 5, 2024 02:58 1h 47m 33s develop
November 5, 2024 02:58 1h 47m 33s
Feature: Optimized memory management on DSP (#5361)
Doxygen Documentation Deployment #534: Commit ddf990f pushed by mohanchen
November 5, 2024 02:29 29m 3s develop
November 5, 2024 02:29 29m 3s
Fix: disable the XC in LibXC in which nonlocal dispersion correction …
Doxygen Documentation Deployment #533: Commit 535c7f9 pushed by mohanchen
November 5, 2024 02:27 1m 24s develop
November 5, 2024 02:27 1m 24s
LRCG (#5399)
Doxygen Documentation Deployment #532: Commit e5768ec pushed by mohanchen
November 4, 2024 03:57 36m 38s develop
November 4, 2024 03:57 36m 38s
Docs: Add Chinese wiki page link to README (#5382)
Doxygen Documentation Deployment #531: Commit d9984c8 pushed by mohanchen
November 4, 2024 03:52 4m 20s develop
November 4, 2024 03:52 4m 20s
Feature: Add CG algorithm to pyabacus.hsolver (#5398)
Doxygen Documentation Deployment #530: Commit 5f9a1c6 pushed by mohanchen
November 4, 2024 03:52 1m 0s develop
November 4, 2024 03:52 1m 0s
Fix cal_edm_tddft (#5396)
Doxygen Documentation Deployment #529: Commit 628bdc6 pushed by mohanchen
November 4, 2024 03:50 1m 19s develop
November 4, 2024 03:50 1m 19s