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531 workflow run results
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Fix: v_delta_precalc error in DeePKS. (#6106) Doxygen Documentation Deployment #906: Commit a338c25 pushed by ErjieWu
3m 58s develop
develop
3m 58s
Refactor: Simplify some functions in DeePKS. (#6102) Doxygen Documentation Deployment #905: Commit ab2e27a pushed by mohanchen
4m 1s develop
develop
4m 1s
Feature: ldos in pw basis set (#6100) Doxygen Documentation Deployment #904: Commit b930866 pushed by mohanchen
4m 10s develop
develop
4m 10s
Feature: print the expectation value of angular momentum operators Lx… Doxygen Documentation Deployment #903: Commit 0ec12d9 pushed by mohanchen
2m 31s develop
develop
2m 31s
Remove uncapsulted scalapack functions in dftu_occup.cpp (#6099) Doxygen Documentation Deployment #902: Commit dce3681 pushed by mohanchen
57s develop
develop
57s
20250403-fix a typo(missing newline) in cuda.md (#6103) Doxygen Documentation Deployment #901: Commit 7d65d73 pushed by mohanchen
1m 29s develop
develop
1m 29s
changing test 218 (#6088) Doxygen Documentation Deployment #900: Commit dce058a pushed by dyzheng
4m 5s develop
develop
4m 5s
Update Hamiltonian and Operator classes (#6084) Doxygen Documentation Deployment #899: Commit ce45c3f pushed by YuLiu98
4m 5s develop
develop
4m 5s
Rafactor:remove GlobalC::rhopw (#6093) Doxygen Documentation Deployment #898: Commit 06cffb7 pushed by mohanchen
3m 53s develop
develop
3m 53s
Docs: Correct intro to output in quickstart (#6095) Doxygen Documentation Deployment #897: Commit d1d14f2 pushed by mohanchen
4m 3s develop
develop
4m 3s
Refactor: Remove C++17 syntax and optimize DMR calculation in DeePKS.… Doxygen Documentation Deployment #896: Commit e3193c8 pushed by mohanchen
4m 5s develop
develop
4m 5s
Fix: std::out_of_range of map when out_mat_t with multi-core (#6090) Doxygen Documentation Deployment #895: Commit 6207798 pushed by mohanchen
4m 10s develop
develop
4m 10s
Refactor: replace 3.14 using PI (#6085) Doxygen Documentation Deployment #894: Commit bbf41aa pushed by YuLiu98
3m 57s develop
develop
3m 57s
Fix: Sign problem in DeePKS cal_pdm(). (#6082) Doxygen Documentation Deployment #893: Commit 60a408a pushed by mohanchen
4m 18s develop
develop
4m 18s
Update ABACUS output formats, accept it after 3.10 version (#6076) Doxygen Documentation Deployment #892: Commit 35448cb pushed by mohanchen
4m 5s develop
develop
4m 5s
modify warning output (#6074) Doxygen Documentation Deployment #891: Commit 39b03c1 pushed by mohanchen
4m 10s develop
develop
4m 10s
Tests: remove mock of print func in md/esolver tests (#6073) Doxygen Documentation Deployment #890: Commit 26d8284 pushed by mohanchen
8m 31s develop
develop
8m 31s
Refactor: reduce the memory consumption of cal_gint_vlocal (#6069) Doxygen Documentation Deployment #889: Commit 2fead84 pushed by mohanchen
1m 7s develop
develop
1m 7s
fixing issue #5961 (#6071) Doxygen Documentation Deployment #888: Commit 5b19d01 pushed by mohanchen
5m 44s develop
develop
5m 44s
Refactor:Change potentials to module_pot (#6070) Doxygen Documentation Deployment #887: Commit cac78df pushed by mohanchen
2m 21s develop
develop
2m 21s
add a check before calculating EXX force (#6067) Doxygen Documentation Deployment #886: Commit e506d00 pushed by mohanchen
4m 29s develop
develop
4m 29s
Perf: optimize cal_DMR and folding_HR (#6068) Doxygen Documentation Deployment #885: Commit c12bd52 pushed by mohanchen
46s develop
develop
46s
fix an output for debug (#6066) Doxygen Documentation Deployment #884: Commit 8b24258 pushed by mohanchen
4m 11s develop
develop
4m 11s
Refactor: Remove some files in DeePKS and add some features. (#6065) Doxygen Documentation Deployment #883: Commit 391b41b pushed by mohanchen
4m 1s develop
develop
4m 1s
Feature&Docs: support the indent control on FmtTable (#6055) Doxygen Documentation Deployment #882: Commit 4adc91b pushed by mohanchen
4m 24s develop
develop
4m 24s