testsuite/functionals/07-sic.02-scdm.inp · 15.0 · octopus-code / octopus

Nov 23, 2023
bb6a661c
Adding the possibility to use the SCDM method for localizing orbitals for PZ-SIC calculations. · bb6a661c
Nicolas Tancogne-Dejean authored Nov 23, 2023
```
A SCDM module is added that allows to get out a states_elec_t object containing the localized states.
The SCDM method is also generalized to spinors.
```
bb6a661c
Adding the possibility to use the SCDM method for localizing orbitals for PZ-SIC calculations.
Nicolas Tancogne-Dejean authored Nov 23, 2023
```
A SCDM module is added that allows to get out a states_elec_t object containing the localized states.
The SCDM method is also generalized to spinors.
```