vasp 
  6.3.2  
  27Jun22 (build Oct 31 2022 01:10:08) complex                          parallel 
  Lin64 
  2023 06 24 
  13:53:45 
 
 
       0
  Normal
  Normal (blocked Davidson)
   F  
       2
       2
       1
    1000
       2
       2
        0.00001000
       -0.02000000
    1000
       3
       1
      400.00000000
        1.62000000      1.26000000      0.73000000
        0.01200000     -0.02200000     -0.00600000     -0.01900000      0.00000000      0.00000000     -0.00100000      0.00000000      0.00600000      0.00200000      0.02000000      0.01400000      0.58500000      0.18800000      0.00300000      0.04600000      0.00500000      0.00100000      0.00000000      0.00000000

   F  
       0
        0.05000000
       1
   F  
   F  
   F  
       1
   T  
       2
      -1    -1    -1
        0.00000000      0.00000000      0.00000000
        0.00000000      0.00000000      0.00000000
 
 
  
   
    
           12.34422659       0.00000000      -0.35425536 
            0.00000000       3.09829954       0.00000000 
           -1.54236328       0.00000000       5.80401989 
    
        220.28831093 
    
            0.08163208       0.00000000       0.02169295 
            0.00000000       0.32275769       0.00000000 
            0.00498251       0.00000000       0.17361843 
    
   
   
           0.13957700       0.50000000       0.24770470 
           0.34382047       0.00000000       0.65586976 
           0.10297348       0.00000000       0.77108230 
           0.39792680       0.50000000       0.18529168 
           0.65024943       0.00000000       0.33855118 
           0.84175181       0.50000000       0.70677749 
           0.59649845       0.50000000       0.81624491 
           0.87964927       0.00000000       0.21858032 
           0.48886516       0.00000000       0.24438995 
           0.01637887       0.50000000       0.79772705 
           0.17572495       0.00000000       0.54792805 
           0.33992173       0.50000000       0.43914396 
           0.34935674       0.50000000       0.86271566 
           0.21894045       0.00000000       0.05005094 
           0.96227437       0.50000000       0.28301707 
           0.51134732       0.00000000       0.75334765 
           0.66638705       0.50000000       0.57424790 
           0.82092762       0.00000000       0.47511054 
           0.82737529       0.00000000       0.89789155 
           0.67005373       0.50000000       0.13432734 
   
  
  
           1 
           2 
           3 
           4 
           5 
           6 
           7 
           8 
           9 
          10 
          11 
          12 
          13 
          14 
          15 
          16 
          17 
          18 
          19 
          20 
  
 
 
  
          2        5        3 
         0.00000000       0.00000000       0.00000000 
         0.50000000       0.00000000       0.00000000 
         0.00000000       0.20000000       0.00000000 
         0.00000000       0.00000000       0.33333333 
         0.00000000       0.00000000       0.00000000 
  
  
          0.00000000       0.00000000       0.00000000 
          0.50000000       0.00000000       0.00000000 
          0.00000000       0.20000000       0.00000000 
          0.50000000       0.20000000       0.00000000 
          0.00000000       0.40000000       0.00000000 
          0.50000000       0.40000000       0.00000000 
          0.00000000       0.00000000       0.33333333 
          0.50000000       0.00000000       0.33333333 
          0.00000000       0.20000000       0.33333333 
          0.50000000       0.20000000       0.33333333 
          0.00000000       0.40000000       0.33333333 
          0.50000000       0.40000000       0.33333333 
  
  
          0.03333333 
          0.03333333 
          0.06666667 
          0.06666667 
          0.06666667 
          0.06666667 
          0.06666667 
          0.06666667 
          0.13333333 
          0.13333333 
          0.13333333 
          0.13333333 
  
 
 
  
   unknown system
    F  
  
  
   normal
       400.00000000
       605.39200000
         0.00001000
       38
       11
      128
       -1
       -1
       174.00000000
        0
        0
        0
        0
         0.00000000
   
         0
          0.05000000
          0.50000000
     T  
     T  
   
   
     F  
          0.00000000      0.00000000      0.00000000
      -100
         2
     F  
   
   
         0
         2
         1
   
   
         2
     F  
          0.01200000     -0.02200000     -0.00600000     -0.01900000      0.00000000      0.00000000     -0.00100000      0.00000000      0.00600000      0.00200000      0.02000000      0.01400000      0.58500000      0.18800000      0.00300000      0.04600000      0.00500000      0.00100000      0.00000000      0.00000000

         -1.00000000
     F  
          0.00000000      0.00000000      1.00000000
     F  
          0.00000000      0.00000000      0.00000000
     F  
   
   
     F  
     F  
   
   
      1000
        -5
         2
        400.00000000
    
      T  
      F  
           0.00100000
           0.00000002
           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
   
  
  
       60
       16
       30
      120
       32
       60
    F  
  
  
     1000
        2
        0
        3
         0.00000000
        -0.02000000
        1
         0.50000000
        -3.00000000
         1.00000000
  
  
         0.00010000
         0.00010000
        1
     1000
      256
        10.00000000
  
  
        2
         0.00001000
  
  
        0
         1.62000000      1.26000000      0.73000000
      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  
       150.36000000     69.72300000     16.00000000
         0.00000000      0.00000000      0.00000000
         1.00000000      1.00000000      1.00000000
    T  
  
   T  
   F  
       0
   T  
       2
      -1
        0.00000000
        0.00000000
       0
       0
  
   --
        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
        1
        1
    F  
    F  
    F  
        0
        0
    F  
         0.00000000
         0.00000000
        0
  
  
    F  
        -0.84910000
         0.12340000
         1.00000000
         0.00000000
  
  
        0
         6.60864933
         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  
    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
        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  
  
 
 
        20 
         3 
  
   ion
   element
   atomtype
   
    Sm   1
    Ga   2
    Ga   2
    Ga   2
    Ga   2
    Ga   2
    Ga   2
    Ga   2
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
    O    3
   
  
  
   type
   atomspertype
   element
   mass
   valence
   pseudopotential
   
       1Sm    150.36000000     11.00000000  PAW_PBE Sm_3 07Sep2000                
       7Ga     69.72300000     13.00000000  PAW_PBE Ga_d 06Jul2010                
      12O      16.00000000      6.00000000  PAW_PBE O 08Apr2002                   
   
  
 
 
  
   
          12.34422659       0.00000000      -0.35425536 
           0.00000000       3.09829954       0.00000000 
          -1.54236328       0.00000000       5.80401989 
   
       220.28831093 
   
           0.08163208       0.00000000       0.02169295 
           0.00000000       0.32275769       0.00000000 
           0.00498251       0.00000000       0.17361843 
   
  
  
          0.13957700       0.50000000       0.24770470 
          0.34382047       0.00000000       0.65586976 
          0.10297348       0.00000000       0.77108230 
          0.39792680       0.50000000       0.18529168 
          0.65024943       0.00000000       0.33855118 
          0.84175181       0.50000000       0.70677749 
          0.59649845       0.50000000       0.81624491 
          0.87964927       0.00000000       0.21858032 
          0.48886516       0.00000000       0.24438995 
          0.01637887       0.50000000       0.79772705 
          0.17572495       0.00000000       0.54792805 
          0.33992173       0.50000000       0.43914396 
          0.34935674       0.50000000       0.86271566 
          0.21894045       0.00000000       0.05005094 
          0.96227437       0.50000000       0.28301707 
          0.51134732       0.00000000       0.75334765 
          0.66638705       0.50000000       0.57424790 
          0.82092762       0.00000000       0.47511054 
          0.82737529       0.00000000       0.89789155 
          0.67005373       0.50000000       0.13432734 
  
 
 
  
       2.77    2.79
       2.79    2.82
   
        987.88633226 
     -14164.93049559 
      -5335.21028221 
        671.04393512 
      16114.62120690 
     -18451.56629012 
         -0.00335145 
         28.42375058 
      21203.43776865 
       1053.70257415 
       1053.70592560 
       1053.70424987 
   
  
  
       3.65    3.67
       3.65    3.67
   
        -80.97545482 
        -80.97545482 
        -80.97545482 
   
  
  
       2.78    2.80
       2.78    2.80
   
       -141.31213107 
       -141.31213107 
       -141.31213107 
   
  
  
       4.99    5.01
       4.99    5.01
   
       -142.08821179 
       -142.08821179 
       -142.08821179 
   
  
  
       2.72    2.74
       2.75    2.77
   
       -142.09926685 
       -142.09926685 
       -142.09926685 
   
  
  
       5.17    5.20
       5.22    5.25
   
       -123.49200491 
       -123.49200491 
       -123.49200491 
   
  
  
       4.22    4.25
       4.26    4.31
   
       -123.27898794 
       -123.27898794 
       -123.27898794 
   
  
  
       5.93    5.95
       5.97    6.00
   
       -123.10244601 
       -123.10244601 
       -123.10244601 
   
  
  
       3.68    3.72
       3.72    3.79
   
       -123.09952488 
       -123.09952488 
       -123.09952488 
   
  
  
       4.79    4.81
       4.84    4.86
   
       -123.10061346 
       -123.10061346 
       -123.10061346 
   
  
  
       4.75    4.77
       4.80    4.83
   
       -123.10129179 
       -123.10129179 
       -123.10129179 
   
  
  
       5.32    5.34
       5.36    5.39
   
       -123.10155155 
       -123.10155155 
       -123.10155155 
   
  
  
       5.08    5.10
       5.12    5.15
   
       -123.10156859 
       -123.10156859 
       -123.10156859 
   
  
  
       5.28    5.30
       5.30    5.33
   
        987.88633226 
     -14164.93049559 
      -5421.02769917 
        681.16046494 
      19415.51821634 
     -21787.09712796 
         -0.00000000 
      -1038.04903224 
      21203.43776865 
       -123.10157276 
       -123.10157276 
       -123.10157276 
   
  
  
   
    
           12.34422659       0.00000000      -0.35425536 
            0.00000000       3.09829954       0.00000000 
           -1.54236328       0.00000000       5.80401989 
    
        220.28831093 
    
            0.08163208       0.00000000       0.02169295 
            0.00000000       0.32275769       0.00000000 
            0.00498251       0.00000000       0.17361843 
    
   
   
           0.13957700       0.50000000       0.24770470 
           0.34382047       0.00000000       0.65586976 
           0.10297348       0.00000000       0.77108230 
           0.39792680       0.50000000       0.18529168 
           0.65024943       0.00000000       0.33855118 
           0.84175181       0.50000000       0.70677749 
           0.59649845       0.50000000       0.81624491 
           0.87964927       0.00000000       0.21858032 
           0.48886516       0.00000000       0.24438995 
           0.01637887       0.50000000       0.79772705 
           0.17572495       0.00000000       0.54792805 
           0.33992173       0.50000000       0.43914396 
           0.34935674       0.50000000       0.86271566 
           0.21894045       0.00000000       0.05005094 
           0.96227437       0.50000000       0.28301707 
           0.51134732       0.00000000       0.75334765 
           0.66638705       0.50000000       0.57424790 
           0.82092762       0.00000000       0.47511054 
           0.82737529       0.00000000       0.89789155 
           0.67005373       0.50000000       0.13432734 
   
  
  
          1.22884705       0.00000000      -0.30648609 
          1.64509492       0.00000000       1.85139288 
          0.42601925       0.00000000       0.14547035 
          1.02043053       0.00000000      -0.78195466 
         -0.77219121       0.00000000      -0.21471009 
         -0.94390596       0.00000000      -0.37426931 
         -0.98620833       0.00000000      -0.24671329 
         -1.31726456       0.00000000      -0.21938755 
         -0.00420616       0.00000000       0.14230075 
          0.13576455       0.00000000       0.21052594 
         -0.73507358       0.00000000      -0.90665107 
         -0.97219136       0.00000000      -0.56923668 
         -0.36531198       0.00000000      -0.31442699 
         -2.11059129       0.00000000       0.85714298 
          0.88412022       0.00000000       0.06674652 
          0.51033717       0.00000000       0.01767159 
          0.69526664       0.00000000      -0.00966255 
          0.73136742       0.00000000       0.02553288 
          0.43413722       0.00000000       0.35138271 
          0.49555946       0.00000000       0.27533166 
  
  
          2.06751448       0.00000000     -13.77971649 
          0.00000000      34.97899560       0.00000000 
        -13.77971701       0.00000000       4.99121200 
  
  
      -123.10157276 
      -123.10157276 
      -123.10157276 
  
     64.21   64.78
 
 
  
       2.91    2.92
       2.95    2.97
   
        974.29582591 
     -14068.78527128 
      -5427.02577003 
        677.72722798 
      19414.95876249 
     -21786.52822252 
         -0.00000000 
      -1111.67538329 
      21203.43776865 
       -123.59506210 
       -123.59506210 
       -123.59506210 
   
  
  
       5.27    5.29
       5.31    5.34
   
       -123.66197217 
       -123.66197217 
       -123.66197217 
   
  
  
       5.78    5.81
       5.82    5.85
   
       -123.46957874 
       -123.46957874 
       -123.46957874 
   
  
  
       5.82    5.84
       5.86    5.89
   
       -123.44169821 
       -123.44169821 
       -123.44169821 
   
  
  
       6.15    6.17
       6.19    6.22
   
       -123.43654325 
       -123.43654325 
       -123.43654325 
   
  
  
       6.03    6.05
       6.07    6.10
   
       -123.43581150 
       -123.43581150 
       -123.43581150 
   
  
  
       6.10    6.12
       6.14    6.18
   
       -123.43584454 
       -123.43584454 
       -123.43584454 
   
  
  
       4.64    4.66
       4.68    4.71
   
       -123.43585980 
       -123.43585980 
       -123.43585980 
   
  
  
       4.44    4.45
       4.45    4.47
   
        974.29582591 
     -14068.78527128 
      -5475.35765409 
        680.61623033 
      19431.04005574 
     -21801.14130660 
         -0.00000000 
      -1067.54150889 
      21203.43776865 
       -123.43586023 
       -123.43586023 
       -123.43586023 
   
  
  
   
    
           12.35430993       0.00000000      -0.41125569 
            0.00000000       3.13424241       0.00000000 
           -1.56994562       0.00000000       5.82067624 
    
        223.36112476 
    
            0.08167675       0.00000000       0.02202975 
            0.00000000       0.31905637       0.00000000 
            0.00577081       0.00000000       0.17335784 
    
   
   
           0.14409564       0.50000000       0.24543301 
           0.35223663       0.00000000       0.67177211 
           0.10480345       0.00000000       0.77240313 
           0.40112707       0.50000000       0.17898745 
           0.64698373       0.00000000       0.33656720 
           0.83764289       0.50000000       0.70341579 
           0.59235642       0.50000000       0.81394143 
           0.87423209       0.00000000       0.21642614 
           0.48899752       0.00000000       0.24558082 
           0.01713385       0.50000000       0.79952301 
           0.17188129       0.00000000       0.54015742 
           0.33549738       0.50000000       0.43414245 
           0.34758903       0.50000000       0.85999427 
           0.21152565       0.00000000       0.05672289 
           0.96582602       0.50000000       0.28378864 
           0.51337560       0.00000000       0.75361833 
           0.66911500       0.50000000       0.57433409 
           0.82383457       0.00000000       0.47550020 
           0.82945272       0.00000000       0.90093902 
           0.67229346       0.50000000       0.13675258 
   
  
  
         -1.11229110       0.00000000       0.26650169 
         -0.76820514       0.00000000      -0.62123417 
         -0.52579297       0.00000000      -0.93271011 
         -0.61909839       0.00000000       0.57913037 
          0.87760428       0.00000000       0.19671640 
          0.50631512       0.00000000       0.30763812 
          0.90556851       0.00000000       0.22299652 
          1.12551439       0.00000000       0.35702962 
         -0.18024442       0.00000000      -0.07294680 
          0.19313502       0.00000000       0.09112702 
          0.30045132       0.00000000       0.37402681 
          0.99253862       0.00000000      -0.18582439 
          0.08500900       0.00000000       0.20305529 
          0.00159478       0.00000000       0.16114195 
         -0.45924006       0.00000000      -0.37815188 
          0.26072495       0.00000000      -0.02691102 
         -0.65369917       0.00000000       0.13138524 
         -0.58114592       0.00000000       0.31959131 
         -0.07773682       0.00000000      -0.61953384 
         -0.27100200       0.00000000      -0.37302811 
  
  
         -8.66045261       0.00000000       3.06021089 
          0.00000000      -2.30383429       0.00000000 
          3.06021050       0.00000000      -4.65132556 
  
  
      -123.43586023 
      -123.43586023 
      -123.43586023 
  
     50.16   50.58
 
 
  
       2.82    2.83
       2.86    2.88
   
        978.63879741 
     -14102.53075356 
      -5471.07370387 
        681.69160955 
      19430.97482500 
     -21801.07193999 
         -0.00000000 
      -1043.62881960 
      21203.43776865 
       -123.56221640 
       -123.56221640 
       -123.56221640 
   
  
  
       4.99    5.02
       5.04    5.06
   
       -123.55517453 
       -123.55517453 
       -123.55517453 
   
  
  
       5.26    5.28
       5.30    5.33
   
       -123.53619035 
       -123.53619035 
       -123.53619035 
   
  
  
       6.67    6.69
       6.72    6.75
   
       -123.53245328 
       -123.53245328 
       -123.53245328 
   
  
  
       4.87    4.89
       4.92    4.94
   
       -123.53234174 
       -123.53234174 
       -123.53234174 
   
  
  
       5.99    6.01
       6.03    6.06
   
       -123.53235658 
       -123.53235658 
       -123.53235658 
   
  
  
       4.76    4.78
       4.78    4.80
   
        978.63879741 
     -14102.53075356 
      -5455.83318730 
        680.78489450 
      19416.15973093 
     -21786.69845825 
         -0.00000000 
      -1057.49114648 
      21203.43776865 
       -123.53235410 
       -123.53235410 
       -123.53235410 
   
  
  
   
    
           12.35105837       0.00000000      -0.39287486 
            0.00000000       3.12265196       0.00000000 
           -1.56105117       0.00000000       5.81530508 
    
        222.36990001 
    
            0.08166201       0.00000000       0.02192122 
            0.00000000       0.32024062       0.00000000 
            0.00551699       0.00000000       0.17344099 
    
   
   
           0.14263927       0.50000000       0.24614924 
           0.34951183       0.00000000       0.66663143 
           0.10421228       0.00000000       0.77197257 
           0.40009847       0.50000000       0.18100469 
           0.64803848       0.00000000       0.33721557 
           0.83897050       0.50000000       0.70450989 
           0.59369408       0.50000000       0.81469533 
           0.87598103       0.00000000       0.21713606 
           0.48895409       0.00000000       0.24519743 
           0.01688920       0.50000000       0.79894306 
           0.17312601       0.00000000       0.54266854 
           0.33692775       0.50000000       0.43576490 
           0.34816096       0.50000000       0.86087504 
           0.21391367       0.00000000       0.05460075 
           0.96467976       0.50000000       0.28352926 
           0.51272109       0.00000000       0.75352486 
           0.66823489       0.50000000       0.57429773 
           0.82289653       0.00000000       0.47536568 
           0.82878067       0.00000000       0.89995241 
           0.67156943       0.50000000       0.13596556 
   
  
  
         -0.29759813       0.00000000       0.07794570 
         -0.03072832       0.00000000       0.13861087 
         -0.22244065       0.00000000      -0.57861606 
         -0.12342189       0.00000000       0.16322822 
          0.34216877       0.00000000       0.06355808 
          0.01770561       0.00000000       0.08061128 
          0.30004941       0.00000000       0.06596487 
          0.36561234       0.00000000       0.19072392 
         -0.10242272       0.00000000       0.00272673 
          0.17104410       0.00000000       0.13106572 
          0.03138918       0.00000000      -0.02840160 
          0.33093046       0.00000000      -0.35022248 
         -0.05671497       0.00000000       0.04532797 
         -0.68715851       0.00000000       0.41416156 
         -0.04407005       0.00000000      -0.24892600 
          0.30734651       0.00000000      -0.01734255 
         -0.19903171       0.00000000       0.11393731 
         -0.16964116       0.00000000       0.21225879 
          0.08393356       0.00000000      -0.30545158 
         -0.01695184       0.00000000      -0.17116076 
  
  
         -7.45457283       0.00000000      -2.09328659 
          0.00000000       6.70980509       0.00000000 
         -2.09328637       0.00000000      -3.59180394 
  
  
      -123.53235410 
      -123.53235410 
      -123.53235410 
  
     38.32   38.67
 
 
  
       2.76    2.78
       2.81    2.82
   
        978.78295494 
     -14113.36000682 
      -5446.04861635 
        680.86424142 
      19416.18195908 
     -21786.70470787 
         -0.00000000 
      -1056.73621102 
      21203.43776865 
       -123.58261798 
       -123.58261798 
       -123.58261798 
   
  
  
       5.27    5.29
       5.32    5.34
   
       -123.60424507 
       -123.60424507 
       -123.60424507 
   
  
  
       4.25    4.32
       4.30    4.38
   
       -123.59776385 
       -123.59776385 
       -123.59776385 
   
  
  
       6.15    6.18
       6.20    6.23
   
       -123.59648706 
       -123.59648706 
       -123.59648706 
   
  
  
       3.26    3.28
       3.31    3.32
   
       -123.59650085 
       -123.59650085 
       -123.59650085