element(s):
['Ni']
AFLOW prototype label:
A_hP2_194_c
Parameter names:
['a', 'c/a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['2.582', '1.5943455']
model name:
MEAM_LAMMPS_MaiselKoZhang_2017_VNiTi__MO_744610363128_001
==== Building ASE atoms object with: ====
representative atom symbols =  ['Ni']
representative atom coordinates =  [[0.33333333 0.66666667 0.25      ]]
spacegroup =  194
cell =  [[2.582, 0, 0], [-1.291, 2.2360775925714, 0], [0, 0, 4.1166]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:57:21       -8.791403         1.046036
BFGS:    1 15:57:21       -8.825510         0.848266
BFGS:    2 15:57:21       -8.877288         0.200596
BFGS:    3 15:57:21       -8.877905         0.175397
BFGS:    4 15:57:21       -8.880051         0.006994
BFGS:    5 15:57:21       -8.880055         0.001103
BFGS:    6 15:57:21       -8.880055         0.000001
BFGS:    7 15:57:21       -8.880055         0.000000
Minimization converged after 7 steps.
Maximum force component: 6.710486992093405e-32 eV/Angstrom
Maximum stress component: 3.2237782228430006e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Ni', 'Ni']
basis =  [[0.33333333 0.66666667 0.25      ]
 [0.66666666 0.33333334 0.75      ]]
cellpar =  Cell([[2.486504683590755, -6.351246252320026e-18, 4.0200111966158437e-38], [-1.2432523417953776, 2.1533762226185806, 8.03591036751581e-38], [1.6979952226682856e-36, 5.887711666258696e-36, 4.0831453744084465]])
forces =  [[ 2.55404471e-33  4.42373520e-33  6.71048699e-32]
 [-2.55404471e-33 -4.42373520e-33 -6.71048699e-32]]
stress =  [-1.59484616e-11 -1.59484616e-11 -3.22377822e-11 -1.86915123e-33
 -8.09366223e-34 -5.08434090e-27]
energy per atom =  -4.440027470228071
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0