element(s):
['Pt']
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:
['3.949']
model name:
QUIP_GAP_Xu_2003_Pt__MO_370837021112_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Pt']
representative atom coordinates =  [[0 0 0]]
spacegroup =  225
cell =  [[3.949, 0, 0], [0, 3.949, 0], [0, 0, 3.949]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 18:30:32      -25.874055        0.1462
BFGS:    1 18:30:32      -25.874834        0.1024
BFGS:    2 18:30:32      -25.875572        0.0020
BFGS:    3 18:30:32      -25.875573        0.0000
BFGS:    4 18:30:32      -25.875573        0.0000
Minimization converged after 4 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 3.592428237535719e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Pt', 'Pt', 'Pt', 'Pt']
basis =  [[0.000000e+00 0.000000e+00 0.000000e+00]
 [0.000000e+00 5.000000e-01 5.000000e-01]
 [5.000000e-01 0.000000e+00 5.000000e-01]
 [5.000000e-01 5.000000e-01 3.816725e-37]]
cellpar =  Cell([[3.9422090124925924, -2.08430042911913e-33, 4.237897637967143e-34], [-1.6480374286396831e-32, 3.9422090124925924, 2.1805695394189515e-20], [6.752950086871126e-34, 2.1805695394188534e-20, 3.9422090124925924]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 3.59242824e-10  3.59242824e-10  3.59242824e-10 -2.62729244e-27
 -5.41439411e-31  3.54626897e-49]
energy per atom =  -0.5804004090234409
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0