vasp 
  6.4.3  
  19Mar24 (build May 12 2024 01:18:22) complex                          parallel 
  Lin64 
  2024 09 12 
  09:06:38 
 
 
  Cs8Na3YAgIn2BiCl24  (P1) ~ Cs2InAgCl6.cif  (VASP)
       0
  Accurate
  Damped
   F  
       2
       2
       1
    1000
       2
      -1
        0.00001000
       -0.02000000
       0
       2
       1
      500.00000000
     291
        2.35000000      1.46000000      1.62000000      1.44000000      1.54000000      1.34000000      0.99000000
   F  
        0.40000000
       0
        0.05000000
       1
   F  
   F  
   F  
   T  
  MBJ
   T  
       1
 
 
  
   
    
           10.55556527       0.00000000       0.00000000 
            0.00000000      10.59851926       0.00000000 
            0.00000000       0.00000000      10.59851926 
    
       1185.69197987 
    
            0.09473675       0.00000000       0.00000000 
            0.00000000       0.09435280       0.00000000 
            0.00000000       0.00000000       0.09435280 
    
   
   
           0.25615146       0.25154081       0.74845919 
           0.25615146       0.74845919       0.74845919 
           0.25615146       0.74845919       0.25154081 
           0.25615146       0.25154081       0.25154081 
           0.74384854       0.25154081       0.25154081 
           0.74384854       0.74845919       0.25154081 
           0.74384854       0.74845919       0.74845919 
           0.74384854       0.25154081       0.74845919 
           0.00000000       0.00000000       0.00000000 
           0.00000000       0.50000000       0.50000000 
           0.50000000       0.00000000       0.50000000 
           0.50000000       0.50000000       0.00000000 
           0.50000000       0.00000000       0.00000000 
           0.00000000       0.00000000       0.50000000 
           0.00000000       0.50000000       0.00000000 
           0.50000000       0.50000000       0.50000000 
           0.25267233       0.00000000       0.00000000 
           0.50000000       0.00000000       0.73799001 
           0.74732767       0.00000000       0.00000000 
           0.50000000       0.73799001       0.00000000 
           0.50000000       0.26200999       0.00000000 
           0.00000000       0.00000000       0.74848936 
           0.25001990       0.50000000       0.50000000 
           0.50000000       0.50000000       0.24118143 
           0.74998010       0.50000000       0.50000000 
           0.50000000       0.24118143       0.50000000 
           0.50000000       0.75881857       0.50000000 
           0.00000000       0.50000000       0.25551942 
           0.73738011       0.00000000       0.50000000 
           0.00000000       0.00000000       0.25151064 
           0.26261989       0.00000000       0.50000000 
           0.00000000       0.74448058       0.50000000 
           0.00000000       0.25551942       0.50000000 
           0.50000000       0.00000000       0.26200999 
           0.73738011       0.50000000       0.00000000 
           0.00000000       0.50000000       0.74448058 
           0.26261989       0.50000000       0.00000000 
           0.00000000       0.25151064       0.00000000 
           0.00000000       0.74848936       0.00000000 
           0.50000000       0.50000000       0.75881857 
   
  
  
           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 
          36 
          37 
          38 
          39 
          40 
  
 
 
  
          3        3        3 
         0.00000000       0.00000000       0.00000000 
         0.33333333       0.00000000       0.00000000 
         0.00000000       0.33333333       0.00000000 
         0.00000000       0.00000000       0.33333333 
         0.00000000       0.00000000       0.00000000 
  
  
          0.00000000       0.00000000       0.00000000 
          0.33333333       0.00000000       0.00000000 
          0.00000000       0.33333333       0.00000000 
          0.33333333       0.33333333       0.00000000 
          0.00000000       0.33333333       0.33333333 
          0.33333333       0.33333333       0.33333333 
  
  
          0.03703704 
          0.07407407 
          0.14814815 
          0.29629630 
          0.14814815 
          0.29629630 
  
 
 
  
   Cs8Na3YAgIn2BiCl24  (P1) ~ Cs2InAgCl6.ci
    F  
  
  
   accura
       500.00000000
       470.88900000
         0.00001000
       53
       10
      320
       -1
       -1
       324.00000000
        0
        0
        0
        0
         0.00000000
   
         0
          0.05000000
          0.50000000
     T  
     T  
   
   
     F  
          0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000
      -100
         2
     F  
   
   
         0
         2
         1
   
   
         2
     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      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  
   
   
     T  
   
   
      1000
        -5
         2
        500.00000000
    
      T  
      F  
           0.00000000
           0.00000001
           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
     F  
   
  
  
       80
       80
       80
      160
      160
      160
    F  
  
  
        0
       -1
        0
        2
         0.00000000
        -0.02000000
        0
         0.50000000
        -3.00000000
         1.00000000
  
  
         0.00010000
         0.00010000
        1
        1
      256
        10.00000000
  
  
        2
         0.00001000
  
  
        0
         2.35000000      1.46000000      1.62000000      1.44000000      1.54000000      1.34000000      0.99000000
      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
  
  
       64
        4
       -1
    T  
    F  
    F  
    F  
    F  
    F  
  
  
        3
       -1
    F  
       132.90000000    208.98000000     88.90600000    114.82000000     22.99000000    107.86800000     35.45300000
         0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000
         1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000
    T  
  
   T  
   F  
       0
   F  
       0
  
   MBJ
   1
        1
    F  
   
    F  
    F  
    F  
    F  
    F  
    F  
        -1.00000000
        0
        0
         0.00000000
         0.00000000
         0.00000000
         1.00000000
         1.00000000
         1.00000000
         1.00000000
         1.00000000
         1.00000000
        1
        1
        1
    F  
    F  
    F  
        0
        0
    F  
         0.00000000
         0.00000000
        0
  
  
    F  
       -1
    F  
        -0.84910000
         1.39626340
         0.00000000
         0.12340000
         1.00000000
         6.30000000
         0.00930000
  
  
        0
        17.78537970
         1.00000000
  
  
    F  
    F  
    F  
    F  
         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  
       -1
       -1
    F  
    F  
    F  
    F  
    T  
        0
       -1     0     0     0
    F  
    F  
    F  
    F  
    F  
    F  
        2
    F  
    F  
    F  
    F  
    F  
    F  
        -1.60000002
        -1.60000002
        -1.00000000
    F  
         0.01000000
       15
       -1
         0.00000000
        0
        0
       -1
       -1
       -1
        1
        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
  
  
        1
    F  
  
  
    F  
  
 
 
        40 
         7 
  
   ion
   element
   atomtype
   
    Cs   1
    Cs   1
    Cs   1
    Cs   1
    Cs   1
    Cs   1
    Cs   1
    Cs   1
    Bi   2
    Y    3
    In   4
    In   4
    Na   5
    Na   5
    Na   5
    Ag   6
    Cl   7
    Cl   7
    Cl   7
    Cl   7
    Cl   7
    Cl   7
    Cl   7
    Cl   7
    Cl   7
    Cl   7
    Cl   7
    Cl   7
    Cl   7
    Cl   7
    Cl   7
    Cl   7
    Cl   7
    Cl   7
    Cl   7
    Cl   7
    Cl   7
    Cl   7
    Cl   7
    Cl   7
   
  
  
   type
   atomspertype
   element
   mass
   valence
   pseudopotential
   
       8Cs    132.90000000      9.00000000  PAW_PBE Cs_sv 08Apr2002               
       1Bi    208.98000000     15.00000000  PAW_PBE Bi_d 06Sep2000                
       1Y      88.90600000     11.00000000  PAW_PBE Y_sv 25May2007                
       2In    114.82000000     13.00000000  PAW_PBE In_d 06Sep2000                
       3Na     22.99000000      7.00000000  PAW_PBE Na_pv 19Sep2006               
       1Ag    107.86800000     11.00000000  PAW_PBE Ag 02Apr2005                  
      24Cl     35.45300000      7.00000000  PAW_PBE Cl 06Sep2000                  
   
  
 
 
  
   
          10.55556527       0.00000000       0.00000000 
           0.00000000      10.59851926       0.00000000 
           0.00000000       0.00000000      10.59851926 
   
      1185.69197987 
   
           0.09473675       0.00000000       0.00000000 
           0.00000000       0.09435280       0.00000000 
           0.00000000       0.00000000       0.09435280 
   
  
  
          0.25615146       0.25154081       0.74845919 
          0.25615146       0.74845919       0.74845919 
          0.25615146       0.74845919       0.25154081 
          0.25615146       0.25154081       0.25154081 
          0.74384854       0.25154081       0.25154081 
          0.74384854       0.74845919       0.25154081 
          0.74384854       0.74845919       0.74845919 
          0.74384854       0.25154081       0.74845919 
          0.00000000       0.00000000       0.00000000 
          0.00000000       0.50000000       0.50000000 
          0.50000000       0.00000000       0.50000000 
          0.50000000       0.50000000       0.00000000 
          0.50000000       0.00000000       0.00000000 
          0.00000000       0.00000000       0.50000000 
          0.00000000       0.50000000       0.00000000 
          0.50000000       0.50000000       0.50000000 
          0.25267233       0.00000000       0.00000000 
          0.50000000       0.00000000       0.73799001 
          0.74732767       0.00000000       0.00000000 
          0.50000000       0.73799001       0.00000000 
          0.50000000       0.26200999       0.00000000 
          0.00000000       0.00000000       0.74848936 
          0.25001990       0.50000000       0.50000000 
          0.50000000       0.50000000       0.24118143 
          0.74998010       0.50000000       0.50000000 
          0.50000000       0.24118143       0.50000000 
          0.50000000       0.75881857       0.50000000 
          0.00000000       0.50000000       0.25551942 
          0.73738011       0.00000000       0.50000000 
          0.00000000       0.00000000       0.25151064 
          0.26261989       0.00000000       0.50000000 
          0.00000000       0.74448058       0.50000000 
          0.00000000       0.25551942       0.50000000 
          0.50000000       0.00000000       0.26200999 
          0.73738011       0.50000000       0.00000000 
          0.00000000       0.50000000       0.74448058 
          0.26261989       0.50000000       0.00000000 
          0.00000000       0.25151064       0.00000000 
          0.00000000       0.74848936       0.00000000 
          0.50000000       0.50000000       0.75881857 
  
 
 
  
         1.00000000 
      25.99   26.14
   
        817.31406934 
     -16840.38305326 
      -6124.82645172 
     317357.14524277 
      18651.76432067 
     -12449.03912358 
         -0.00886525 
    **************** 
      23773.95583886 
    **************** 
    **************** 
    **************** 
   
  
  
      30.05   30.23
   
    **************** 
    **************** 
    **************** 
   
  
  
      32.63   32.83
   
    **************** 
    **************** 
    **************** 
   
  
  
      32.22   32.42
   
    **************** 
    **************** 
    **************** 
   
  
  
      36.68   36.92
   
    **************** 
    **************** 
    **************** 
   
  
  
         1.20966703