vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2025 05 17 
  22:59:10 
 
 
  No title
       0
  Normal
  Normal (blocked Davidson)
   F  
       1
       2
       1
     200
       2
      -1
        0.00001000
       -0.02000000
       0
       2
       1
      400.00000000
        1.11000000      0.73000000      0.77000000      0.32000000
  Auto
       1
        0.20000000
       1
   F  
   F  
       1
 
 
  
   
    
           15.00000000       0.00000000       0.00000000 
            0.00000000      10.00000000       0.00000000 
            0.00000000       0.00000000      10.00000000 
    
       1500.00000000 
    
            0.06666667       0.00000000       0.00000000 
            0.00000000       0.10000000       0.00000000 
            0.00000000       0.00000000       0.10000000 
    
   
   
           0.16402786       0.57191217       0.72903673 
           0.37354472       0.61876369       0.68749162 
           0.26857417       0.62254545       0.73197773 
           0.38848976       0.67884032       0.51110446 
           0.43567992       0.72111842       0.81581830 
           0.15825946       0.38538304       0.74412700 
           0.10900452       0.63204533       0.57207519 
           0.12055720       0.63542130       0.84793188 
           0.45848869       0.67322963       0.47864090 
           0.36724623       0.78437839       0.50824110 
           0.34838216       0.62280264       0.43830685 
           0.50476221       0.73726163       0.78270850 
           0.43623524       0.66320014       0.90958234 
           0.08826981       0.35219811       0.74733145 
           0.19116716       0.35059179       0.83609214 
           0.19069423       0.33580378       0.65866879 
           0.13977948       0.58734930       0.48261773 
           0.11404427       0.74147596       0.56320089 
           0.03778114       0.60525819       0.57219089 
           0.40691467       0.81955288       0.83718379 
           0.55943624       0.39963680       0.67557923 
           0.50929761       0.39047699       0.66802473 
   
  
  
           1 
           2 
           3 
           4 
           5 
           6 
           7 
           8 
           9 
          10 
          11 
          12 
          13 
          14 
          15 
          16 
          17 
          18 
          19 
          20 
          21 
          22 
  
 
 
  
          1        2        2 
         0.00000000       0.00000000       0.00000000 
         1.00000000       0.00000000       0.00000000 
         0.00000000       0.50000000       0.00000000 
         0.00000000       0.00000000       0.50000000 
         0.00000000       0.00000000       0.00000000 
  
  
          0.00000000       0.00000000       0.00000000 
          0.00000000       0.50000000       0.00000000 
          0.00000000       0.00000000       0.50000000 
          0.00000000       0.50000000       0.50000000 
  
  
          0.25000000 
          0.25000000 
          0.25000000 
          0.25000000 
  
 
 
  
   No title
    F  
  
  
   normal
       400.00000000
       644.87300000
         0.00001000
       38
       10
       36
       -1
       -1
        45.00000000
        0
        0
        0
        0
         0.00000000
   
         1
          0.20000000
          0.50000000
     T  
     T  
   
   
     T  
         -0.00050000     -0.00050000     -0.00050000     -0.00050000
      -100
         2
     F  
   
   
         0
         2
         1
   
   
         1
     F  
          1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000
      1.00000000      1.00000000
         -1.00000000
     F  
          0.00000000      0.00000000      1.00000000
     F  
          0.00000000      0.00000000      0.00000000
     F  
   
   
     F  
     F  
   
   
       200
        -5
         2
        400.00000000
    
      T  
      F  
           0.00000000
           0.00000007
           0.30000000
          4
           0.40000000
    
   
   
          0.40000000
          1.00000000
          0.10000000
          1.60000000
          1.00000000
    
          4
      F  
        -45
         100.00000000
          1
          1
          5
    
   
   
     F  
     F  
         0
          1.00000000
       -100.00000000   -100.00000000   -100.00000000
          0.00000000
   
  
  
       80
       50
       50
      160
      100
      100
    F  
  
  
        0
       -1
        0
        2
         0.00000000
        -0.02000000
        0
         0.50000000
        -3.00000000
         1.00000000
  
  
         0.00010000
         0.00010000
        1
        1
      256
        16.00000000
  
  
        2
         0.00001000
  
  
        0
         1.11000000      0.73000000      0.77000000      0.32000000
      301
        10.00000000
       -10.00000000
         0.00000000
  
  
        1
    F  
    F  
    F  
    F  
    F  
    F  
    F  
    F  
         0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000
  
  
        3
        4
       -1
    T  
    F  
    F  
    F  
    F  
    F  
  
  
        3
       -1
    F  
        28.08500000     16.00000000     12.01100000      1.00000000
         0.00000000      0.00000000      0.00000000      0.00000000
         1.00000000      1.00000000      1.00000000      1.00000000
    T  
  
   T  
   F  
       0
   F  
       0
  
   --
        1
    F  
   
    F  
    F  
    F  
    F  
    F  
        -1.00000000
        0
        0
         0.00000000
         0.00000000
         0.00000000
         1.00000000
         1.00000000
         1.00000000
         1.00000000
        1
        1
        1
    F  
    F  
    F  
        0
        0
    F  
         0.00000000
         0.00000000
        0
  
  
    F  
        -0.84910000
         0.12340000
         1.00000000
         0.00000000
  
  
        0
        40.90909091
         1.00000000
  
  
    F  
    F  
    F  
    F  
        0
         0.10000000
        -1.00000000
         0.00200000
        -0.10000000
         0.00000000
         0.00000000      0.00000000      0.00000000
         0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000
  
  
    F  
         0.00000000      0.00000000      0.00000000
    T  
    F  
    F  
    F  
    T  
        0
         0.00000000      0.00000000      0.00000000
         0.00000000      0.00000000      0.00000000
  
  
    F  
    F  
    F  
    F  
    T  
        0
       -1     0     0     0
    F  
    F  
    F  
    F  
    F  
    F  
        2
    F  
    F  
    F  
    F  
    F  
    F  
        -2.00000000
        -2.00000000
        -1.00000000
    F  
       -1
         0.00000000
        0
        0
       -1
       -1
       -1
      200
        1
        3
        4
        0
       -30.00000000
       -30.00000000
      -200.00000000
        0
        -0.10000000
    F  
    F  
    F  
    F  
    F  
    F  
    F  
        1
        1
        1
     2800
        0
       -1
       -1
         0.80000001
         1.00000000
  
  
         0.00000000
         0.00000000      0.00000000      0.00000000
         0.00000000
         0.00000000
         0.00000000
  
  
    F  
  
 
 
        22 
         4 
  
   ion
   element
   atomtype
   
    Si   1
    Si   1
    O    2
    C    3
    C    3
    C    3
    C    3
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
   
  
  
   type
   atomspertype
   element
   mass
   valence
   pseudopotential
   
       2Si     28.08500000      4.00000000  PAW_PBE Si 05Jan2001                  
       1O      16.00000000      6.00000000  PAW_PBE O 08Apr2002                   
       4C      12.01100000      4.00000000  PAW_PBE C 08Apr2002                   
      15H       1.00000000      1.00000000  PAW_PBE H 15Jun2001                   
   
  
 
 
  
   
          15.00000000       0.00000000       0.00000000 
           0.00000000      10.00000000       0.00000000 
           0.00000000       0.00000000      10.00000000 
   
      1500.00000000 
   
           0.06666667       0.00000000       0.00000000 
           0.00000000       0.10000000       0.00000000 
           0.00000000       0.00000000       0.10000000 
   
  
  
          0.16402786       0.57191217       0.72903673 
          0.37354472       0.61876369       0.68749162 
          0.26857417       0.62254545       0.73197773 
          0.38848976       0.67884032       0.51110446 
          0.43567992       0.72111842       0.81581830 
          0.15825946       0.38538304       0.74412700 
          0.10900452       0.63204533       0.57207519 
          0.12055720       0.63542130       0.84793188 
          0.45848869       0.67322963       0.47864090 
          0.36724623       0.78437839       0.50824110 
          0.34838216       0.62280264       0.43830685 
          0.50476221       0.73726163       0.78270850 
          0.43623524       0.66320014       0.90958234 
          0.08826981       0.35219811       0.74733145 
          0.19116716       0.35059179       0.83609214 
          0.19069423       0.33580378       0.65866879 
          0.13977948       0.58734930       0.48261773 
          0.11404427       0.74147596       0.56320089 
          0.03778114       0.60525819       0.57219089 
          0.40691467       0.81955288       0.83718379 
          0.55943624       0.39963680       0.67557923 
          0.50929761       0.39047699       0.66802473 
  
  
     T  T  T 
     T  T  T 
     F  F  F 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     F  F  F 
     T  T  T 
     T  T  T 
  
  
         -3.00000000       0.00000000       0.00010000       0.00010000 
  
 
 
  
   
   
   
          4.76039610 
       1338.69703003 
      -2320.78585359 
         95.04520433 
        988.89567318 
       -957.91857019 
         -0.00817204 
       -289.24583566 
       1414.08307395 
        273.52294611 
        273.53111815 
        273.52567012 
   
  
  
   
   
   
        -39.61908872 
        -39.62526292 
        -39.62114679 
   
  
  
   
   
   
       -119.32698380 
       -119.27590899 
       -119.30995886 
   
  
  
   
   
   
       -124.40885575 
       -124.35248710 
       -124.39006620 
   
  
  
   
   
   
       -124.56303677 
       -124.50661894 
       -124.54423083 
   
  
  
   
   
   
       -111.37453870 
       -111.31812129 
       -111.35573289 
   
  
  
   
   
   
       -109.86991281 
       -109.81350384 
       -109.85110982 
   
  
  
   
   
   
       -109.36073708 
       -109.30432986 
       -109.34193468 
   
  
  
   
   
   
       -109.20369606 
       -109.14729543 
       -109.18489585 
   
  
  
   
   
   
       -109.19483683 
       -109.13843804 
       -109.17603723 
   
  
  
   
   
   
       -109.18848511 
       -109.13208986 
       -109.16968669 
   
  
  
   
   
   
       -109.18972646 
       -109.13333073 
       -109.17092788 
   
  
  
   
   
   
       -109.19596291 
       -109.13956592 
       -109.17716391 
   
  
  
   
   
   
       -109.19970681 
       -109.14330707 
       -109.18090690 
   
  
  
   
   
   
       -109.20334563 
       -109.14694433 
       -109.18454520 
   
  
  
   
   
   
       -109.20763858 
       -109.15123813 
       -109.18883843 
   
  
  
   
   
   
       -109.20946246 
       -109.15306289 
       -109.19066260 
   
  
  
   
   
   
       -109.21019724 
       -109.15379851 
       -109.19139767