Dcaspt2-input-generator

Changes

- Release dcaspt2\_input\_generator 0.1.0 github-actions (27)

🚀 Features

- Create standard IVO input kohei-noda-qcrg (25)

🐛 Bug Fixes

- Prepared for v0.0.4 (bugfix and refactor) kohei-noda-qcrg (26)

Changes

- Release dcaspt2\_input\_generator 0.0.3 github-actions (24)

🚀 Features

- Resolved an issue that appeared to hang during sum\_dirac\_dfcoef execution using QProcess kohei-noda-qcrg (23)

Changes

- Release dcaspt2\_input\_generator 0.0.2 github-actions (22)
- Update the usage description minoria-hiroshima (https://github.com/RQC-HU/dcaspt2_input_generator/commit/ed0db723386a6a071b3027f1f80875122c119ff3)
🐛 Bug Fixes

- Don't set table\_data.header\_info.moltra\_info value to False for orbitals outside the MOLTRA range. kohei-noda-qcrg (21)

- This is the first published version of this project 👍

Changes

- Release dcaspt2\_input\_generator 0.0.1 github-actions (20)
- Update installation instructions in README kohei-noda-qcrg (18)
- Add write permissions for contents and pull requests kohei-noda-qcrg (16)
- Skip first row when creating row dictionary in TableWidget kohei-noda-qcrg (14)
- Fix-linter-bug-and-warnings kohei-noda-qcrg (13)
- Update README.md kohei-noda-qcrg (7)

🚀 Features

- Read and use eigenvalues info kohei-noda-qcrg (15)
- Python packaging kohei-noda-qcrg (6)
- Refactor the natural number input kohei-noda-qcrg (4)
- Fix sum\_dirac\_dfcoef command, Add Open with sum\_dirac\_dfcoef output option kohei-noda-qcrg (2)

🐛 Bug Fixes

- Read and use eigenvalues info kohei-noda-qcrg (15)
- Chore-output kohei-noda-qcrg (12)
- Fix the position of window error Augus1999 (11)
- Use pyqt5 instead of PySide6 kohei-noda-qcrg (10)
- Fix drop file kohei-noda-qcrg (9)
- Fix window pos issue kohei-noda-qcrg (8)