How to compute BSSE
go back to Main Page, Computational Resources, GAUSSIAN, G09
To compute the basis set superposition error (BSSE) in gas phase you can use the Counterpoise keyword. Check the example BSSE_gasphase.in.
go back to Main Page, Computational Resources, GAUSSIAN, G09
To compute the basis set superposition error (BSSE) in gas phase you can use the Counterpoise keyword. Check the example BSSE_gasphase.in.