ADF Output Examples#
First, the examples must be imported using
import rgmol.examples
The examples are :
Chloromethane, PBE0 TZP, Full CDFT
file = rgmol.examples.adf_CH3ClMethane, PBE0 TZP, Full CDFT
file = rgmol.examples.adf_CH4
First, the examples must be imported using
import rgmol.examples
The examples are :
Chloromethane, PBE0 TZP, Full CDFT
file = rgmol.examples.adf_CH3ClMethane, PBE0 TZP, Full CDFT
file = rgmol.examples.adf_CH4