 *********************************************************
 *                                                       *
 *                  WELCOME TO ABACUS                    *
 *                                                       *
 *            'Atomic-orbital Based Ab-initio            *
 *                  Computation at UStc'                 *
 *                                                       *
 *          Website: http://abacus.ustc.edu.cn/          *
 *                                                       *
 *********************************************************
 Fri Jul 23 13:50:09 2021
 MAKE THE DIR         : OUT.ABACUS/
 DONE(0.100071   SEC) : SETUP UNITCELL
 DONE(0.10381    SEC) : INIT K-POINTS
 ---------------------------------------------------------
 Self-consistent calculations for electrons
 ---------------------------------------------------------
 SPIN    KPOINTS         PROCESSORS  
 1       8               1           
 ---------------------------------------------------------
 Use plane wave basis
 ---------------------------------------------------------
 ELEMENT NATOM       XC          
 Si      2           PZ-LDA
 ---------------------------------------------------------
 Initial plane wave basis and FFT box
 ---------------------------------------------------------
 DONE(0.137769   SEC) : INIT PLANEWAVE
 UNIFORM GRID DIM     : 36 * 36 * 36
 UNIFORM GRID DIM(BIG): 36 * 36 * 36
 MEMORY FOR PSI (MB)  : 1.55371
 DONE(0.152475   SEC) : LOCAL POTENTIAL
 DONE(0.173766   SEC) : NON-LOCAL POTENTIAL
 START POTENTIAL      : atomic
 DONE(0.19781    SEC) : INIT POTENTIAL
 DONE(0.32454    SEC) : INIT BASIS
 -------------------------------------------
 SELF-CONSISTENT : 
 -------------------------------------------
 ITER   ETOT(eV)       EDIFF(eV)      SCF_THR      CG_ITER    TIME(S)    
 CG1    -2.129663e+02  0.000000e+00   1.186e-01  2.562e+00  1.190e+00  
 CG2    -2.130767e+02  -1.104173e-01  3.657e-03  2.078e+00  1.050e+00  
 CG3    -2.130811e+02  -4.416948e-03  4.365e-05  2.641e+00  1.200e+00  
 CG4    -2.130817e+02  -5.664048e-04  1.144e-06  3.453e+00  1.280e+00  
 CG5    -2.130817e+02  -1.765094e-06  3.044e-08  2.391e+00  1.140e+00  
 CG6    -2.130817e+02  -1.185365e-07  1.340e-10  3.219e+00  1.360e+00  

  |CLASS_NAME---------|NAME---------------|TIME(Sec)-----|CALLS----|AVG------|PER%-------
                       total               2.1795         15        0.15      1e+02     %
   Run_pw              plane_wave_line     2.1412         1         2.1       98        %
   Cell_PW             opt_cells_pw        2.0256         1         2         93        %
   FFT                 FFT3D               1.4318         3400      0.00042   66        %
   Hamilt_PW           diagH_subspace      0.39471        48        0.0082    18        %
   Hamilt_PW           h_psi               1.4959         1158      0.0013    69        %
   Hamilt_PW           vloc                1.4367         1158      0.0012    66        %
   Ions                opt_ions_pw         1.8403         1         1.8       84        %
   Electrons           self_consistent     1.8403         1         1.8       84        %
   Electrons           c_bands             0.90846        3         0.3       42        %
   Hamilt              diagH_pw            1.4987         48        0.031     69        %
   Diago_CG            diag                1.1751         48        0.024     54        %
   electrons           c_bands             0.93526        3         0.31      43        %
   Charge              sum_band            0.2343         6         0.039     11        %
 ----------------------------------------------------------------------------------------

 START  Time  : Fri Jul 23 13:50:09 2021
 FINISH Time  : Fri Jul 23 13:50:11 2021
 TOTAL  Time  : 2
 SEE INFORMATION IN : OUT.ABACUS/
