subroutine exchange_matrix_MO_basis(nBas,c,P,G,K) ! Compute exchange matrix in the MO basis implicit none include 'parameters.h' ! Input variables integer,intent(in) :: nBas double precision,intent(in) :: c(nBas,nBas),P(nBas,nBas) double precision,intent(in) :: G(nBas,nBas,nBas,nBas) ! Output variables double precision,intent(out) :: K(nBas,nBas) ! Compute Hartree Hamiltonian in the AO basis call exchange_matrix_AO_basis(nBas,P,G,K) ! Transform Coulomb matrix in the MO basis K = matmul(transpose(c),matmul(K,c)) end subroutine exchange_matrix_MO_basis