ATOMIC SPHERE DEPENDENT PARAMETERS FOR ATOM Ni1 :e__0001: OVERALL ENERGY PARAMETER IS 0.3000 OVERALL BASIS SET ON ATOM IS LAPW :E1_0001: E( 1)= 0.3000 APW+lo :E1_0001: E( 1)= -4.2800 E(BOTTOM)= -4.340 E(TOP)= -4.220 LOCAL ORBITAL :E2_0001: E( 2)= 0.2650 E(BOTTOM)= -0.040 E(TOP)= 0.570 APW+lo :E0_0001: E( 0)= 0.3000 APW+lo ATOMIC SPHERE DEPENDENT PARAMETERS FOR ATOM O 1 :e__0002: OVERALL ENERGY PARAMETER IS 0.3000 OVERALL BASIS SET ON ATOM IS LAPW :E0_0002: E( 0)= -0.8250 E(BOTTOM)= -1.630 E(TOP)= -0.020 APW+lo :E0_0002: E( 0)= 0.3000 LOCAL ORBITAL :E1_0002: E( 1)= 0.3000 APW+lo K= 0.00000 0.00000 0.00000 1 :RKM : MATRIX SIZE 130LOs: 17 RKM= 6.56 WEIGHT= 1.00 PGR: EIGENVALUES ARE: :EIG00001: -4.2694667 -4.2694667 -4.2694667 -0.9407268 0.2813368 :EIG00006: 0.2813368 0.2813368 0.3006791 0.3006791 0.3405011 :EIG00011: 0.3405011 0.3405011 0.6248583 1.8063009 1.9131467 :EIG00016: 1.9131467 1.9131467 ******************************************************** :KPT : NUMBER OF K-POINTS: 72