

In [1]:

    
from pycalphad import Database

dbf = Database('mmc1-test.dat')









    



['System',
 'Fe-O-e(Spinel)',
 3,
 1,
 [5],
 2,
 {'Fe': 55.845, 'O': 15.9994, 'e(Spinel)': 0.00054858},
 [6, 1, 2, 3, 4, 5, 6],
 [6, 1, 2, 3, 4, 5, 6],
 ['gas_ideal',
  'IDMX',
  [['O',
    4,
    3,
    [0.0, 1.0, 0.0],
    [[2200.0,
      242682.2,
      -30.020448,
      -19.964968,
      -0.00013194946,
      6.1589319e-09,
      -29327.439],
     ['1',
      83.809856,
      0.5,
      [6000.0, -84471.471, 186.78944, -38.050669, 0.0, 0.0, 12120739.0]],
     ['2',
      70811.436,
      99.0,
      -8330.8535,
      0.5,
      [6001.0, 236685.0, -8.3771889, -22.291487, 0.0, 0.0, 0.0]],
     ['1', 0.0, 0.0]]],
   ['O2',
    4,
    4,
    [0.0, 2.0, 0.0],
    [[1000.0,
      -5219.3324,
      -12.179856,
      -26.924057,
      -0.0084893408,
      1.1276942e-06,
      -114664.63],
     ['1',
      -316.64663,
      0.5,
      [4000.0,
       -389938.78,
       638.67678,
       -89.681327,
       0.00072372244,
       0.0,
       9341343.0]],
     ['2',
      -16506.149,
      0.5,
      95803.96,
      99.0,
      [6000.0, -8951197.1, 2742.7612, -249.17312, 0.0, 0.0, 592489210.0]],
     ['2',
      -139742.68,
      0.5,
      1674792.2,
      99.0,
      [6001.0, -42014.302, 116.92408, -44.371534, 0.0, 0.0, 0.0]],
     ['1', 0.0, 0.0]]],
   ['O3',
    4,
    3,
    [0.0, 3.0, 0.0],
    [[1900.0,
      200310.28,
      315.13014,
      -76.555764,
      0.0046115697,
      -3.2267167e-07,
      -821844.45],
     ['1',
      -15871.007,
      99.0,
      [6000.0, -95706.532, 344.94952, -73.713624, 0.0, 0.0, 9320171.5]],
     ['2',
      47079.583,
      99.0,
      -6138.341,
      0.5,
      [6001.0, 107048.81, 191.83924, -61.231023, 0.0, 0.0, 0.0]],
     ['1', 0.0, 0.0]]],
   ['Fe',
    4,
    1,
    [1.0, 0.0, 0.0],
    [[6000.0, 398104.44, 8.2908473, -27.062112, 0.0, 0.0, 0.0],
     ['1', 0.0, 0.0]]],
   ['FeO',
    4,
    4,
    [1.0, 1.0, 0.0],
    [[1600.0,
      264803.57,
      73.8781,
      -45.086391,
      0.0024171143,
      -2.1947562e-07,
      -253638.11],
     ['1',
      -5386.0381,
      99.0,
      [3900.0,
       -835030.31,
       1185.8168,
       -140.03746,
       0.0013685586,
       0.0,
       31173911.0]],
     ['2',
      253414.3,
      99.0,
      -37141.239,
      0.5,
      [6000.0, 2605868.6, -473.96633, -2.4118912, 0.0, 0.0, -151092820.0]],
     ['2',
      -436463.46,
      99.0,
      32771.727,
      0.5,
      [6001.0, 215668.36, 70.785429, -43.83232, 0.0, 0.0, 0.0]],
     ['1', 0.0, 0.0]]]]],
 ['Fe2O3_hematite(s)',
  [[16,
    2,
    [2.0, 3.0, 0.0],
    [[2500.0, -859683.05, 828.05005, -137.00893, 0.0, 0.0, 1453820.0],
     ['1', 0.0, 0.0, [2501.0, -857356.94, 823.7123, -136.54371, 0.0, 0.0, 0.0]],
     ['1', 0.0, 0.0]],
    [-2867.0, -25.1, 0.333333, 0.28]]]],
 ['Fe_bcc(s)',
  '#',
  [[16,
    2,
    [1.0, 0.0, 0.0],
    [[1811.0, 1225.7, 124.134, -23.5143, -0.00439752, -5.89269e-08, 77358.5],
     ['1', 0.0, 0.0, [1812.0, -24287.831, 298.76801, -46.0, 0.0, 0.0, 0.0]],
     ['1', 0.0, 0.0]],
    [1043.0, 2.22, 1.0, 0.4]]]],
 '']