element(s):
['Ni']
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:
['2.7844']
model name:
SNAP_LiHuChen_2018_NiMo__MO_468686727341_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Ni']
representative atom coordinates =  [[0 0 0]]
spacegroup =  229
cell =  [[2.7844, 0, 0], [0, 2.7844, 0], [0, 0, 2.7844]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:09:26      -11.422176         0.091398
BFGS:    1 16:09:26      -11.422479         0.063303
BFGS:    2 16:09:26      -11.422762         0.001018
BFGS:    3 16:09:26      -11.422762         0.000012
BFGS:    4 16:09:26      -11.422762         0.000000
Minimization converged after 4 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 2.0536779497336738e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ni', 'Ni']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.7903812462665285, 3.6091286570707012e-37, 2.3475739335371182e-33], [-2.3883985502588936e-38, 2.7903812462665285, -1.2854956466606316e-21], [2.0781787388499566e-34, -1.285495646665049e-21, 2.7903812462665285]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-2.05367795e-10 -2.05367795e-10 -2.05367795e-10  1.02637401e-29
  6.59602251e-35 -7.32516040e-51]
energy per atom =  -2.7797180254469187
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0