CdSalcList

class psi4.core.CdSalcList

Bases: object

Class for generating symmetry adapted linear combinations

Methods Summary

matrix(…) Return the SALCs
matrix_irrep((self: psi4.core.CdSalcList, …) Return only the SALCS in irrep h
print_out((self: psi4.core.CdSalcList) -> None) Print the SALC to the output file

Methods Documentation

matrix(self: psi4.core.CdSalcList) → psi4.core.Matrix

Return the SALCs

matrix_irrep(self: psi4.core.CdSalcList, h: int) → psi4.core.Matrix

Return only the SALCS in irrep h

print_out(self: psi4.core.CdSalcList) → None

Print the SALC to the output file

matrix(self: psi4.core.CdSalcList) → psi4.core.Matrix

Return the SALCs

matrix_irrep(self: psi4.core.CdSalcList, h: int) → psi4.core.Matrix

Return only the SALCS in irrep h

print_out(self: psi4.core.CdSalcList) → None

Print the SALC to the output file