Dear uses, the following is some data of my calculation: ATOMIC SPHERE DEPENDENT PARAMETERS FOR ATOM O 1 OVERALL ENERGY PARAMETER IS 0.3000 OVERALL BASIS SET ON ATOM IS LAPW E( 0)= -1.0300 E(BOTTOM)= -2.370 E(TOP)= 0.310 LAPW E( 0)= 0.3000 LOCAL ORBITAL E( 1)= 0.3000 LAPW My question: should I change the E(TOP) to be negative? thanks.