ATOMIC SPHERE DEPENDENT PARAMETERS FOR ATOM U :e__0001: OVERALL ENERGY PARAMETER IS 0.3000 OVERALL BASIS SET ON ATOM IS LAPW :E0_0001: E( 0)= 0.3000 APW+lo :E0_0001: E( 0)= -2.1790 E(BOTTOM)= -2.260 E(TOP)= -2.098 LOCAL ORBITAL :E1_0001: E( 1)= -0.3990 E(BOTTOM)= -0.702 E(TOP)= -0.096 APW+lo :E1_0001: E( 1)= 0.3000 LOCAL ORBITAL :E3_0001: E( 3)= 0.9200 E(BOTTOM)= 0.920 E(TOP)= -200.000 APW+lo :E2_0001: E( 2)= 0.6800 E(BOTTOM)= 0.680 E(TOP)= -200.000 APW+lo ATOMIC SPHERE DEPENDENT PARAMETERS FOR ATOM N :e__0002: OVERALL ENERGY PARAMETER IS 0.3000 OVERALL BASIS SET ON ATOM IS LAPW :E0_0002: E( 0)= -1.1500 E(BOTTOM)= -1.410 E(TOP)= -200.000 APW+lo :E0_0002: E( 0)= 0.6000 LOCAL ORBITAL :E1_0002: E( 1)= 0.3000 APW+lo K= 0.00000 0.00000 0.00000 1 :RKM : MATRIX SIZE 634LOs: 25 RKM= 8.97 WEIGHT= 1.00 PGR: EIGENVALUES ARE: :EIG00001: -2.1836705 -0.3091703 -0.3091703 -0.3091703 -0.1586765 :EIG00006: 0.6956529 0.6956529 0.6956529 0.9594643 1.0368823 :EIG00011: 1.0368823 1.0368823 1.1072331 1.1487442 1.1487442 :EIG00016: 1.1487442 1.2482229 1.2482229 1.2482229 1.2704234 :EIG00021: 1.2704234 1.8984305 2.9399678 2.9399678 2.9399678 :EIG00026: 3.0803219 3.0803219 3.0803219 3.3026654 3.3026654 :EIG00031: 3.3456187 3.4659644 3.4659644 3.4659644 4.2197996 :EIG00036: 4.2197996 4.2197996 4.3647446 4.3647446 4.6128062 :EIG00041: 4.6128062 4.6128062 4.7471061 4.7471061 4.7471061 :EIG00046: 4.8546310 4.9581023 4.9581023 4.9581023 ******************************************************** :KPT : NUMBER OF K-POINTS: 72