2 unstable releases
| 0.2.0 | Nov 7, 2023 |
|---|---|
| 0.1.0 | Nov 7, 2023 |
#249 in Science
4KB
76 lines
Utility program to compute adiabatic energies from DFT/MRCI output files
Dependencies
~2.2–3MB
~53K SLoC
| 0.2.0 | Nov 7, 2023 |
|---|---|
| 0.1.0 | Nov 7, 2023 |
#249 in Science
4KB
76 lines
Utility program to compute adiabatic energies from DFT/MRCI output files
~2.2–3MB
~53K SLoC