Skip to content

Actions: Quantum-Dynamics-Hub/libra-code

Actions

Super-Linter

Actions

Loading...
Loading

Show workflow options

Create status badge

Loading
superlinter.yml
110 workflow runs
110 workflow runs

Filter by Event

⌥ + click/return to exclude

Filter by Status

⌥ + click/return to exclude

Filter by Branch

⌥ + click/return to exclude

Filter by Actor

⌥ + click/return to exclude
Merge pull request #276 from jieyang464/feature-pyscf-interface Super-Linter #119: Commit 82a73cf pushed by alexvakimov
50m 1s devel
devel
50m 1s
Added the workflow function for interfacing Libra with PySCF; unfortu… Super-Linter #118: Commit 2085ff8 pushed by alexvakimov
54m 9s devel
devel
54m 9s
Added Lowdin orthogonalization to the DFTB+ workflow Super-Linter #117: Commit f0d9ed4 pushed by alexvakimov
55m 13s devel
devel
55m 13s
Added the module implementing Lowdin orthogonalization, added this co… Super-Linter #116: Commit d8b5fc3 pushed by alexvakimov
53m 18s devel
devel
53m 18s
Cleaned up the implmenentation and docstrings of the cube_file_method… Super-Linter #115: Commit dee3019 pushed by alexvakimov
57m 48s devel
devel
57m 48s
Updated citools.interfaces to add the excitation parity phase Super-Linter #114: Commit 9acaa7b pushed by alexvakimov
55m 53s devel
devel
55m 53s
Added a fix for excitation parity phase Super-Linter #113: Commit 6e91d4d pushed by alexvakimov
53m 3s devel
devel
53m 3s
Updating __init__.py Super-Linter #112: Commit 890befe pushed by alexvakimov
58m 9s devel
devel
58m 9s
Merge pull request #274 from jieyang464/feature-pyscf-interface Super-Linter #111: Commit 74a8240 pushed by alexvakimov
58m 47s devel
devel
58m 47s
Added some optional debug printouts (commented for now) in the citool… Super-Linter #110: Commit c734d76 pushed by alexvakimov
57m 1s devel
devel
57m 1s
Added a few minor fixes in citools modules, revision of the read_cp2k… Super-Linter #109: Commit 7d76682 pushed by alexvakimov
56m 1s devel
devel
56m 1s
updated citation in preparation for relase Super-Linter #108: Commit 862f532 pushed by alexvakimov
55m 41s v5.12.0
v5.12.0
55m 41s
updated citation in preparation for relase Super-Linter #107: Commit 862f532 pushed by alexvakimov
48m 1s master
master
48m 1s
updated citation in preparation for relase Super-Linter #106: Commit 862f532 pushed by alexvakimov
55m 51s devel
devel
55m 51s
in the run_dftb, made it optional to run either GS or excited state c… Super-Linter #105: Commit 7230d97 pushed by alexvakimov
56m 0s devel
devel
56m 0s
Revised many of the DFTB+ auxiliary functions to make them thread-saf… Super-Linter #104: Commit 051c7b8 pushed by alexvakimov
48m 11s devel
devel
48m 11s
Merge pull request #272 from suarez-va/devel Super-Linter #103: Commit 1533bee pushed by alexvakimov
58m 3s devel
devel
58m 3s
hotfixes in KCRPMD to make it compiled Super-Linter #102: Commit 9658161 pushed by alexvakimov
55m 29s devel
devel
55m 29s
Solved merge conflicts in KCRPMD by using the devel stuff Super-Linter #101: Commit 04f1954 pushed by alexvakimov
56m 57s master
master
56m 57s
Merge branch 'devel' of https://github.com/Quantum-Dynamics-Hub/libra… Super-Linter #100: Commit 934e0f4 pushed by alexvakimov
55m 31s devel
devel
55m 31s
Merge pull request #271 from suarez-va/devel Super-Linter #99: Commit 79ce3fc pushed by alexvakimov
1h 0m 33s devel
devel
1h 0m 33s
Merge pull request #270 from sbaldu/refactor/fixing-warnings Super-Linter #98: Commit 1b5a2df pushed by alexvakimov
53m 51s master
master
53m 51s
Merge pull request #269 from sbaldu/chore/add-cmake-build-gitignore Super-Linter #97: Commit 7392365 pushed by alexvakimov
53m 34s master
master
53m 34s
Added higher-level utility functions for formulating NBRA and non-NBR… Super-Linter #96: Commit a56ca7f pushed by alexvakimov
57m 15s devel
devel
57m 15s
Added extended documentation of the new functions in dftbplus.methods Super-Linter #95: Commit dce229e pushed by alexvakimov
56m 2s devel
devel
56m 2s