vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2024 09 03 
  16:41:46 
 
 
  No title
       0
  Normal
  Normal (blocked Davidson)
   F  
       2
       2
       1
     200
       2
      -1
        0.00001000
       -0.02000000
       0
       2
       1
      400.00000000
        1.11000000      0.73000000      0.32000000
        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      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      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.10700000
  Auto
       1
        0.20000000
       1
   F  
   F  
       1
 
 
  
   
    
            7.66310000       0.00000000       0.00000000 
            0.00000000      19.66310000       0.00000000 
            0.00000000       0.00000000      10.83726000 
    
       1632.96160543 
    
            0.13049549       0.00000000       0.00000000 
            0.00000000       0.05085668       0.00000000 
            0.00000000       0.00000000       0.09227425 
    
   
   
           0.00563506       0.07536494       0.49776852 
           0.95168366       0.18516575       0.62036106 
           0.93479562       0.00366089       0.71770700 
           0.16314440       0.68449676       0.56422959 
           0.91194765       0.51304460       0.68859164 
           0.35315149       0.77799664       0.78859502 
           0.05471238       0.27657368       0.48978115 
           0.85300137       0.05949310       0.74031929 
           0.21286414       0.99932887       0.56786524 
           0.60614789       0.69638095       0.64746016 
           0.51832253       0.70608903       0.14032657 
           0.64650328       0.11227073       0.66329248 
           0.58414298       0.88120794       0.77455316 
           0.03953332       0.84490881       0.05187965 
           0.90321191       0.61026318       0.76017818 
           0.04249483       0.40800662       0.41738232 
           0.74141913       0.74159652       0.13410766 
           0.78871437       0.27779270       0.57903269 
           0.43733049       0.77020079       0.45165768 
           0.71227085       0.84707855       0.57199271 
           0.15040122       0.66078456       0.57116184 
           0.76498381       0.17867806       0.16556499 
           0.31325655       0.37674308       0.79877626 
           0.09659649       0.36114414       0.84176494 
           0.96152635       0.16933707       0.62830110 
           0.79255259       0.29617367       0.86296973 
           0.72030851       0.25654699       0.37822480 
           0.11555496       0.68814723       0.56282290 
           0.15059645       0.56675552       0.01621660 
           0.81527430       0.64540730       0.67335684 
           0.72501822       0.15960597       0.86851945 
           0.99795712       0.41258654       0.80692513 
           0.13813679       0.52103378       0.83048983 
           0.59201881       0.70757309       0.27831039 
           0.05166182       0.37466248       0.05220260 
   
  
  
           1 
           2 
           3 
           4 
           5 
           6 
           7 
           8 
           9 
          10 
          11 
          12 
          13 
          14 
          15 
          16 
          17 
          18 
          19 
          20 
          21 
          22 
          23 
          24 
          25 
          26 
          27 
          28 
          29 
          30 
          31 
          32 
          33 
          34 
          35 
  
 
 
  
          2        1        2 
         0.00000000       0.00000000       0.00000000 
         0.50000000       0.00000000       0.00000000 
         0.00000000       1.00000000       0.00000000 
         0.00000000       0.00000000       0.50000000 
         0.00000000       0.00000000       0.00000000 
  
  
          0.00000000       0.00000000       0.00000000 
          0.50000000       0.00000000       0.00000000 
          0.00000000       0.00000000       0.50000000 
          0.50000000       0.00000000       0.50000000 
  
  
          0.25000000 
          0.25000000 
          0.25000000 
          0.25000000 
  
 
 
  
   No title
    F  
  
  
   normal
       400.00000000
       605.39200000
         0.00001000
       38
       10
       88
       -1
       -1
       136.00000000
        0
        0
        0
        0
         0.00000000
   
         1
          0.20000000
          0.50000000
     T  
     T  
   
   
     T  
         -0.00050000     -0.00050000     -0.00050000
      -100
         2
     F  
   
   
         0
         2
         1
   
   
         2
     F  
          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      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      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.10700000
         -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
           0.00000003
           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
   
  
  
       40
       96
       54
       80
      192
      108
    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      0.32000000
      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
  
  
        4
        4
       -1
    T  
    F  
    F  
    F  
    F  
    F  
  
  
        3
       -1
    F  
        28.08500000     16.00000000      1.00000000
         0.00000000      0.00000000      0.00000000
         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
        27.99362752
         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  
  
 
 
        35 
         3 
  
   ion
   element
   atomtype
   
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    Si   1
    O    2
    H    3
    H    3
   
  
  
   type
   atomspertype
   element
   mass
   valence
   pseudopotential
   
      32Si     28.08500000      4.00000000  PAW_PBE Si 05Jan2001                  
       1O      16.00000000      6.00000000  PAW_PBE O 08Apr2002                   
       2H       1.00000000      1.00000000  PAW_PBE H 15Jun2001                   
   
  
 
 
  
   
           7.66310000       0.00000000       0.00000000 
           0.00000000      19.66310000       0.00000000 
           0.00000000       0.00000000      10.83726000 
   
      1632.96160543 
   
           0.13049549       0.00000000       0.00000000 
           0.00000000       0.05085668       0.00000000 
           0.00000000       0.00000000       0.09227425 
   
  
  
          0.00563506       0.07536494       0.49776852 
          0.95168366       0.18516575       0.62036106 
          0.93479562       0.00366089       0.71770700 
          0.16314440       0.68449676       0.56422959 
          0.91194765       0.51304460       0.68859164 
          0.35315149       0.77799664       0.78859502 
          0.05471238       0.27657368       0.48978115 
          0.85300137       0.05949310       0.74031929 
          0.21286414       0.99932887       0.56786524 
          0.60614789       0.69638095       0.64746016 
          0.51832253       0.70608903       0.14032657 
          0.64650328       0.11227073       0.66329248 
          0.58414298       0.88120794       0.77455316 
          0.03953332       0.84490881       0.05187965 
          0.90321191       0.61026318       0.76017818 
          0.04249483       0.40800662       0.41738232 
          0.74141913       0.74159652       0.13410766 
          0.78871437       0.27779270       0.57903269 
          0.43733049       0.77020079       0.45165768 
          0.71227085       0.84707855       0.57199271 
          0.15040122       0.66078456       0.57116184 
          0.76498381       0.17867806       0.16556499 
          0.31325655       0.37674308       0.79877626 
          0.09659649       0.36114414       0.84176494 
          0.96152635       0.16933707       0.62830110 
          0.79255259       0.29617367       0.86296973 
          0.72030851       0.25654699       0.37822480 
          0.11555496       0.68814723       0.56282290 
          0.15059645       0.56675552       0.01621660 
          0.81527430       0.64540730       0.67335684 
          0.72501822       0.15960597       0.86851945 
          0.99795712       0.41258654       0.80692513 
          0.13813679       0.52103378       0.83048983 
          0.59201881       0.70757309       0.27831039 
          0.05166182       0.37466248       0.05220260 
  
 
 
  
       5.88    5.95
       6.44    6.51
   
         24.76344702 
        887.26447743 
      -2638.09965710 
       -297.45767417 
       3170.77583059 
      -2609.60722799 
         -0.00418666 
        390.43179364 
       3755.32434067 
       2683.39114344 
       2683.39533010 
       2683.39253900