nanotech-empa / aiida-gaussian / 18296791935

Builds Branch Commit Type Ran Committer Via Coverage
18296791935 pre-commit-ci-update-config [pre-commit.ci] auto fixes from pre-commit.com hooks for more information, see https://pre-commit.ci Pull #33 pre-commit-ci[bot] github
22.62
18296587712 pre-commit-ci-update-config [pre-commit.ci] pre-commit autoupdate updates: - [github.com/pre-commit/pre-commit-hooks: v4.4.0 → v6.0.0](https://github.com/pre-commit/pre-commit-hooks/compare/v4.4.0...v6.0.0) - [github.com/pycqa/isort: 5.12.0 → 6.1.0](https://github.com/pycqa... Pull #33 web-flow github
22.62
16128416448 pre-commit-ci-update-config [pre-commit.ci] auto fixes from pre-commit.com hooks for more information, see https://pre-commit.ci Pull #33 pre-commit-ci[bot] github
22.62
16128274565 pre-commit-ci-update-config [pre-commit.ci] pre-commit autoupdate updates: - [github.com/pre-commit/pre-commit-hooks: v4.4.0 → v5.0.0](https://github.com/pre-commit/pre-commit-hooks/compare/v4.4.0...v5.0.0) - [github.com/pycqa/isort: 5.12.0 → 6.0.1](https://github.com/pycqa... Pull #33 web-flow github
22.62
14319719412 pre-commit-ci-update-config [pre-commit.ci] auto fixes from pre-commit.com hooks for more information, see https://pre-commit.ci Pull #33 pre-commit-ci[bot] github
22.62
14319704284 pre-commit-ci-update-config [pre-commit.ci] pre-commit autoupdate updates: - [github.com/pre-commit/pre-commit-hooks: v4.4.0 → v5.0.0](https://github.com/pre-commit/pre-commit-hooks/compare/v4.4.0...v5.0.0) - [github.com/pycqa/isort: 5.12.0 → 6.0.1](https://github.com/pycqa... push web-flow github
22.62
12643360806 pre-commit-ci-update-config [pre-commit.ci] auto fixes from pre-commit.com hooks for more information, see https://pre-commit.ci Pull #33 pre-commit-ci[bot] github
22.62
12643358802 pre-commit-ci-update-config [pre-commit.ci] pre-commit autoupdate updates: - [github.com/pre-commit/pre-commit-hooks: v4.4.0 → v5.0.0](https://github.com/pre-commit/pre-commit-hooks/compare/v4.4.0...v5.0.0) - [github.com/pycqa/isort: 5.12.0 → 5.13.2](https://github.com/pycq... push web-flow github
22.62
11029866336 v2.2.0 Bump version v2.1.1 -> v2.2.0. push eimrek github
22.62
11029866343 master Bump version v2.1.1 -> v2.2.0. push eimrek github
22.62
11029827676 master Handle ghost atoms and parse NMR output (#41) * added try except to_string VS to_str * modified to allow nics calculations * [pre-commit.ci] auto fixes from pre-commit.com hooks for more information, see https://pre-commit.ci * modify... push web-flow github
22.62
11029702657 festure/nics [pre-commit.ci] auto fixes from pre-commit.com hooks for more information, see https://pre-commit.ci Pull #41 pre-commit-ci[bot] github
22.62
11029699835 festure/nics bug fix nmr_parsing return None push cpignedoli github
22.62
10995350454 festure/nics modify a bit; add example Pull #41 eimrek github
22.62
10832477118 festure/nics Merge 91c3dc667 into 947aa3b73 Pull #41 web-flow github
22.9