calculate_ipldm_redmat.f90 File Reference

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

Function/Subroutine Documentation

calculate_ipldm_redmat()

subroutine calculate_ipldm_redmat

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