theochem
by theochem
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Packages
| Name | Latest Version | Summary | Updated | License |
|---|
| iodata | 0.1.7 | — | Mar 25, 2025 | GNU Version 3 |
| libint | 2.3.1 | two-body molecular integrals over Gaussian functions library | Mar 25, 2025 | GNU General Public License v2 or later (GPLv2+) |
| horton | 2.3.0 | Helpful Open-source Research TOol for N-fermion systems | Mar 25, 2025 | GPLv3.0 |
| gbasis | 0.1.9 | — | Mar 25, 2025 | GNU Version 3 |
| python-cellcutoff | 0.2.3 | CellCutoff is a library for periodic boundary conditions and real-space cutoff calculations. | Mar 25, 2025 | GPL-3.0 |
| libxc | 3.0.0 | Library of exchange-correlation functionals for density-functional theory | Mar 25, 2025 | GNU Lesser General Public License, version 3 |
| pycydemo | 0.3.6 | Python + Cython build tools testing project | Mar 25, 2025 | MIT |
| cellcutoff | 0.2.3 | CellCutoff is a library for periodic boundary conditions and real-space cutoff calculations. | Mar 25, 2025 | GPL-3.0 |
| cppcheck | 1.80 | A static analysis tool for C/C++ code. | Mar 25, 2025 | GPLv3 |
| cardboardlint | 1.3.0 | — | Mar 25, 2025 | GPL-3.0 |
| derivcheck | 1.1.5 | A robust and very sensitive tester for analytic partial derivatives | Mar 25, 2025 | GNU General Public License v3 or later (GPLv3+) |
| doxygen | 1.8.13 | Documentation generator for C++ and other languages. | Mar 25, 2025 | GPLv3 |
| old_grids | 0.0.4 | — | Mar 25, 2025 | GPLv3 |
| qc-procrustes | 1.0.0 | Finding the optimal transformation(s) that makes two matrices as close as possible to each other. | Mar 25, 2025 | GNU Version 3 |
| roberto | 2.0.4 | — | Mar 25, 2025 | GPL-3.0 |
| grid | 0.0.5a6 | — | Mar 25, 2025 | GPLv3 |
| cma | 2.5.3 | — | Mar 25, 2025 | BSD |
| periodic | 0.1.3 | — | Mar 25, 2025 | GNU Version 3 |
| meanfield | 0.0.1 | — | Mar 25, 2025 | GPLv3 |
| python-cgrid | 0.1.0 | CGrid is a library for for molecular numerical integration. | Mar 25, 2025 | GPL3 |
| qc-iodata | 1.0.0a2 | — | Mar 25, 2025 | GNU Version 3 |
| cgrid | 0.1.0 | CGrid is a library for for molecular numerical integration | Mar 25, 2025 | GPL3 |
| horton-manual | 2.1.0 | HORTON: Helpful Open-source Research TOol for N-fermion systems | Mar 25, 2025 | GNU General Public License v3.0 |