element(s):
['Pd']
AFLOW prototype label:
A_cF4_225_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.9372']
model name:
EAM_Dynamo_ZhouZimmermanWong_2008_PdH__MO_114797992931_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Pd']
representative atom coordinates =  [[0 0 0]]
spacegroup =  225
cell =  [[3.9372, 0, 0], [0, 3.9372, 0], [0, 0, 3.9372]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 17:12:42      -15.580411        0.7477
BFGS:    1 17:12:42      -15.602133        0.6073
BFGS:    2 17:12:42      -15.641359        0.0566
BFGS:    3 17:12:42      -15.641672        0.0036
BFGS:    4 17:12:42      -15.641673        0.0000
BFGS:    5 17:12:42      -15.641673        0.0000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 4.439676524929771e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Pd', 'Pd', 'Pd', 'Pd']
basis =  [[0.0000000e+00 0.0000000e+00 0.0000000e+00]
 [1.0567608e-48 5.0000000e-01 5.0000000e-01]
 [5.0000000e-01 0.0000000e+00 5.0000000e-01]
 [5.0000000e-01 5.0000000e-01 0.0000000e+00]]
cellpar =  Cell([[3.884858906755824, 1.477000416881499e-32, 4.042695354365718e-34], [1.268837940223904e-32, 3.884858906755824, -1.0970997814767188e-17], [3.327023912049147e-33, -1.0970997814767192e-17, 3.884858906755824]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-4.43967652e-10 -4.43967652e-10 -4.43967652e-10  3.97684112e-26
 -2.72237974e-34  4.18931310e-51]
energy per atom =  -3.9104182429434595
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0