Open kml5480 opened 7 years ago
MP2 functionality has been added to the code. However, we still need to add a flag to the molecule class that indicates if MP2 is spin-component scaled (SCS_mode).
Still need to address density-fitted MP2.
MP2 functionality has been added to the code. However, we still need to add a flag to the molecule class that indicates if MP2 is spin-component scaled (SCS_mode).
Still need to address density-fitted MP2.