SUBROUTINE Quant_Out (n, kchan, elect, mvib, jrot, lorb, energy, xksq, location) USE FileUnits_Module USE Numeric_Kinds_Module USE Masses_Module USE TotalEng_Module IMPLICIT NONE CHARACTER(LEN=*) location INTEGER n, i, kchan(n), elect(n), mvib(n), jrot(n), lorb(n) REAL(Kind=WP_Kind) energy(n), xksq(n) WRITE(Out_Unit,'(A)')'begin Quant_Out: Location='//TRIM(Location) WRITE(Out_Unit,*)'Quantum Numbers' WRITE(Out_Unit,'(8A)')' i',' kchan',' elect',' mvib',' jrot',' lorb',' energy',' xksq' DO i = 1, n WRITE(Out_Unit,'(6I6,2ES16.7)')i, kchan(i), elect(i), mvib(i), jrot(i), lorb(i), energy(i), xksq(i) IF(ABS(xksq(i)-usys2*(Etot-energy(i)))/ABS(xksq(i))>1.d-4)THEN WRITE(Out_Unit,'(16x,A,3ES16.7)')'ERROR in Quant_Out: ', xksq(i), usys2*(Etot-energy(i)), ABS(xksq(i)-usys2*(Etot-energy(i)))/ABS(xksq(i)) !STOP 'Quant_Out' ENDIF ENDDO WRITE(Out_Unit,'(2A)')'finish Quant_Out: Location=',TRIM(Location) RETURN ENDSUBROUTINE Quant_Out