multicharge¶
Electronegativity equilibration model for atomic partial charges.
homepage: https://github.com/grimme-lab/multicharge
| version | toolchain |
|---|---|
0.2.0 |
gfbf/2022b |
0.2.0 |
iimkl/2022a |
0.2.0 |
iimkl/2022b |
0.3.0 |
gfbf/2023a |
(quick links: (all) - 0 - a - b - c - d - e - f - g - h - i - j - k - l - m - n - o - p - q - r - s - t - u - v - w - x - y - z)