CheMPS2¶
CheMPS2 is a scientific library which contains a spin-adapted implementation of the density matrix renormalization group (DMRG) for ab initio quantum chemistry.
homepage: https://github.com/SebWouters/CheMPS2
| version | toolchain |
|---|---|
1.6 |
intel/2016a |
1.7-rc2 |
intel/2016a |
1.7.1 |
intel/2016a |
1.7.2 |
intel/2016a |
1.8 |
intel/2016b |
1.8.11 |
foss/2021b |
1.8.12 |
foss/2022a |
1.8.12 |
foss/2022b |
1.8.8 |
intel/2018b |
1.8.9 |
foss/2018b |
1.8.9 |
foss/2019a |
1.8.9 |
intel/2018b |
1.8.9 |
intel/2019a |
1.8.9 |
intel/2019b |
(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)