element(s):
['Mn', 'Pd']
AFLOW prototype label:
AB_tP2_123_a_d
Parameter names:
['a', 'c/a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.0981', '1.0744973']
model name:
EAM_Dynamo_SchopfBrommerFrigan_2012_AlMnPd__MO_137572817842_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Mn', 'Pd']
representative atom coordinates =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
spacegroup =  123
cell =  [[3.0981, 0, 0], [0, 3.0981, 0], [0, 0, 3.3289]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 16:32:58       -6.873684        6.1154
BFGS:    1 16:32:58       -7.556784        3.7462
BFGS:    2 16:32:58       -7.866444        0.8676
BFGS:    3 16:32:58       -7.881553        0.8197
BFGS:    4 16:32:58       -7.894512        1.0292
BFGS:    5 16:32:58       -7.946578        1.9116
BFGS:    6 16:32:58       -8.017132        2.7793
BFGS:    7 16:32:58       -8.126128        3.3546
BFGS:    8 16:32:58       -8.268554        3.7385
BFGS:    9 16:32:58       -8.438196        4.0381
BFGS:   10 16:32:58       -8.628452        4.2154
BFGS:   11 16:32:58       -8.830017        4.2419
BFGS:   12 16:32:58       -9.030568        4.1258
BFGS:   13 16:32:58       -9.214451        3.8711
BFGS:   14 16:32:58       -9.365999        3.4693
BFGS:   15 16:32:58       -9.478870        2.8323
BFGS:   16 16:32:58       -9.555773        1.8059
BFGS:   17 16:32:58       -9.596838        1.0843
BFGS:   18 16:32:58       -9.606912        0.4284
BFGS:   19 16:32:58       -9.609074        0.0186
BFGS:   20 16:32:58       -9.609086        0.0015
BFGS:   21 16:32:58       -9.609086        0.0001
BFGS:   22 16:32:58       -9.609086        0.0000
BFGS:   23 16:32:58       -9.609086        0.0000
BFGS:   24 16:32:58       -9.609086        0.0000
Minimization converged after 24 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.827167972816151e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Mn', 'Pd']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.4667286666272674, 3.96984471431274e-34, 4.873800049151163e-32], [-5.4713205435707584e-36, 2.466728666627266, 3.3715753354095496e-17], [2.445579054541136e-33, 6.585685991752681e-17, 4.277865262276682]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 1.82716797e-11  1.82716797e-11 -1.54366462e-11 -2.17317010e-27
 -3.69866972e-44 -1.09587340e-60]
energy per atom =  -4.802560355541641
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0