This is a GUI tool for supporting the generation of input files for DIRAC_CASPT2 calculation.
Project description
dcaspt2_input_generator
Description
- This is a GUI tool for supporting the generation of input files for DIRAC_CASPT2 calculation.
Prerequisites
- Python 3.7 or later
- pip
Install
pip install -U dcaspt2_input_generator
Usage
dcaspt2_input_generator
or
python -m dcaspt2_input_generator
For more information, please see the wiki.
LICENSE
- Apache LICENSE 2.0
Author
- Kohei Noda
Release history Release notifications | RSS feed
Download files
Download the file for your platform. If you're not sure which to choose, learn more about installing packages.
Source Distribution
Built Distribution
Close
Hashes for dcaspt2_input_generator-0.6.2.tar.gz
| Algorithm | Hash digest | |
|---|---|---|
| SHA256 | 42ec320dbc7f63d9a87bca1fd95b3e828f9cd98e6fbd57c6b04615a7fba8305e |
|
| MD5 | 69f30805758ebcf15163a3284b53234a |
|
| BLAKE2b-256 | eda4e62fba5486362f21ab76af4440ce47a871668465f93baec5e9bb8500ebcb |
Close
Hashes for dcaspt2_input_generator-0.6.2-py3-none-any.whl
| Algorithm | Hash digest | |
|---|---|---|
| SHA256 | 0b5a704cc4615d2470bd545b6266ff34b016ee12448f8d2ed86a193ad06c0803 |
|
| MD5 | b7781da271be42a3b28814e27924b065 |
|
| BLAKE2b-256 | 7f5fdd7ec45d36b9e3560e7cb63bd6ac4a4aa3ec06725a7bfdfbaf40eb1cb661 |
