element(s):
['Ni']
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:
['3.5048']
model name:
MEAM_LAMMPS_JeongParkDo_2018_PdNi__MO_008996216289_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['Ni']
representative atom coordinates =  [[0 0 0]]
spacegroup =  225
cell =  [[3.5048, 0, 0], [0, 3.5048, 0], [0, 0, 3.5048]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:33:42      -17.794798         0.184836
BFGS:    1 16:33:42      -17.796157         0.158451
BFGS:    2 16:33:42      -17.799997         0.004164
BFGS:    3 16:33:42      -17.800000         0.000098
BFGS:    4 16:33:42      -17.800000         0.000000
BFGS:    5 16:33:42      -17.800000         0.000000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 8.506430227802055e-14 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ni', 'Ni', 'Ni', 'Ni']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [0.00000000e+00 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 1.70913419e-36 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 1.70913419e-36]]
cellpar =  Cell([[3.521391775416361, -9.250562837140843e-34, -9.556405331118441e-35], [-8.973732323717896e-39, 3.521391775416361, -8.422042358239866e-20], [-1.106434036543515e-33, -8.422042358239661e-20, 3.521391775416361]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-8.50643023e-14 -8.50643023e-14 -8.50643023e-14  1.55701480e-30
 -6.47143439e-37 -1.34338300e-52]
energy per atom =  -4.450000000003612
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0