calculate_pldm_redmat.f90 File Reference

Functions/Subroutines
subroutine	calculate_pldm_redmat
	This subroutine calculates the reduced density matrix using PLDM with a harmonic bath model in the diabatic basis with bilinear coupling. More...

Function/Subroutine Documentation

calculate_pldm_redmat()

subroutine calculate_pldm_redmat

(

)

This subroutine calculates the reduced density matrix using PLDM with a harmonic bath model in the diabatic basis with bilinear coupling.