element(s):
['H']
AFLOW prototype label:
A_cI2_229_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.2058']
model name:
EAM_Dynamo_ZhouBarteltSills_2021_PdHHe__MO_865505436319_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['H']
representative atom coordinates =  [[0 0 0]]
spacegroup =  229
cell =  [[4.2058, 0, 0], [0, 4.2058, 0], [0, 0, 4.2058]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:57:53       18.930522         0.544684
BFGS:    1 16:57:53       18.917682         0.555467
BFGS:    2 16:57:53       18.828980         0.628534
BFGS:    3 16:57:53       18.728754         0.709056
BFGS:    4 16:57:53       18.615916         0.796549
BFGS:    5 16:57:53       18.488767         0.959547
BFGS:    6 16:57:53       18.301870         1.452868
BFGS:    7 16:57:53       18.096127         1.225553
BFGS:    8 16:57:53       17.902852         1.351969
BFGS:    9 16:57:53       17.690756         1.474275
BFGS:   10 16:57:53       17.461378         1.580048
BFGS:   11 16:57:53       17.145658         2.694490
BFGS:   12 16:57:53       16.763192         2.262179
BFGS:   13 16:57:53       16.414238         2.181501
BFGS:   14 16:57:53       16.104048         2.001778
BFGS:   15 16:57:53       15.823007         1.703840
BFGS:   16 16:57:53       15.594956         1.377940
BFGS:   17 16:57:53       15.470715         0.088066
BFGS:   18 16:57:53       15.470302         0.007697
BFGS:   19 16:57:53       15.470299         0.000113
BFGS:   20 16:57:53       15.470299         0.000000
BFGS:   21 16:57:53       15.470299         0.000000
Minimization converged after 21 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.0204623229565715e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['H', 'H']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.500506813720199, 2.077642467551927e-33, -1.0197606281299552e-32], [5.715101100368885e-33, 2.500506813720199, 4.592257005862448e-17], [8.33596480938241e-33, 4.5922570058624483e-17, 2.500506813720199]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-1.02046232e-12 -1.02046232e-12 -1.02046232e-12  6.17573953e-29
 -1.43744482e-34  1.47272871e-51]
energy per atom =  -2.040475366551311
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0