 *********************************************************
 *                                                       *
 *                  WELCOME TO ABACUS                    *
 *                                                       *
 *            'Atomic-orbital Based Ab-initio            *
 *                  Computation at UStc'                 *
 *                                                       *
 *          Website: http://abacus.ustc.edu.cn/          *
 *                                                       *
 *********************************************************
 Wed Aug 18 15:32:21 2021
 MAKE THE DIR         : OUT.autotest/
 DONE(0.197748   SEC) : SETUP UNITCELL
 DONE(0.28925    SEC) : SYMMETRY
 DONE(0.301679   SEC) : INIT K-POINTS
 ---------------------------------------------------------
 Self-consistent calculations for electrons
 ---------------------------------------------------------
 SPIN    KPOINTS         PROCESSORS  
 1       1               1           
 ---------------------------------------------------------
 Use plane wave basis
 ---------------------------------------------------------
 ELEMENT NATOM       XC          
 Si      2           NOX NOC SCAN SCAN
 ---------------------------------------------------------
 Initial plane wave basis and FFT box
 ---------------------------------------------------------
 DONE(0.435724   SEC) : INIT PLANEWAVE
 UNIFORM GRID DIM     : 24 * 24 * 24
 UNIFORM GRID DIM(BIG): 24 * 24 * 24
 MEMORY FOR PSI (MB)  : 0.0376282
 DONE(0.464874   SEC) : LOCAL POTENTIAL
 DONE(0.538426   SEC) : NON-LOCAL POTENTIAL
 START POTENTIAL      : atomic
 DONE(0.588526   SEC) : INIT POTENTIAL
 DONE(0.80074    SEC) : INIT BASIS
 -------------------------------------------
 SELF-CONSISTENT : 
 -------------------------------------------
 ITER   ETOT(eV)       EDIFF(eV)      SCF_THR      CG_ITER    TIME(S)    
 CG1    -1.983062e+02  0.000000e+00   3.395e-01  2.000e+00  5.400e-01  
 CG2    -1.969518e+02  1.354331e+00   1.861e-02  2.000e+00  5.500e-01  
 CG3    -1.970875e+02  -1.356273e-01  5.423e-04  3.000e+00  6.500e-01  
 CG4    -1.971402e+02  -5.277196e-02  2.314e-05  3.000e+00  5.100e-01  
 CG5    -1.971264e+02  1.388320e-02   2.670e-06  3.000e+00  7.300e-01  
 CG6    -1.971291e+02  -2.752991e-03  1.944e-07  2.667e+00  4.600e-01  
 CG7    -1.971287e+02  4.371667e-04   1.801e-09  3.000e+00  8.300e-01  
 CG8    -1.971286e+02  1.100548e-04   1.326e-10  3.000e+00  3.500e-01  

  |CLASS_NAME---------|NAME---------------|TIME(Sec)-----|CALLS----|AVG------|PER%-------
                       total               2.7802         17        0.16      1e+02     %
   Run_pw              plane_wave_line     2.7138         1         2.7       98        %
   PW_Basis            gen_pw              0.13377        1         0.13      4.8       %
   Cell_PW             opt_cells_pw        2.3193         1         2.3       83        %
   Sphbes              Spherical_Bessel    0.13132        2710      4.8e-05   4.7       %
   FFT                 FFT3D               0.40527        1868      0.00022   15        %
   Potential           v_of_rho            0.32126        9         0.036     12        %
   Potential_Libxc     v_xc                1.246          5         0.25      45        %
   Potential_Libxc     v_xc_meta           1.2922         5         0.26      46        %
   WF_atomic           init_at_1           0.15056        1         0.15      5.4       %
   Hamilt_PW           diagH_subspace      0.22783        8         0.028     8.2       %
   Hamilt_PW           h_psi               1.148          144       0.008     41        %
   Hamilt_PW           vloc                0.10352        144       0.00072   3.7       %
   Hamilt_PW           vnl                 0.70405        144       0.0049    25        %
   Hamilt_PW           meta                0.33985        144       0.0024    12        %
   Ions                opt_ions_pw         1.9554         1         2         70        %
   Electrons           self_consistent     1.9554         1         2         70        %
   Electrons           c_bands             1.1941         4         0.3       43        %
   Hamilt              diagH_pw            1.0951         8         0.14      39        %
   Diago_CG            diag                0.92784        8         0.12      33        %
   electrons           c_bands             0.87922        4         0.22      32        %
 ----------------------------------------------------------------------------------------

 START  Time  : Wed Aug 18 15:32:21 2021
 FINISH Time  : Wed Aug 18 15:32:23 2021
 TOTAL  Time  : 2
 SEE INFORMATION IN : OUT.autotest/
