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:
EAM_Dynamo_ZhouJohnsonWadley_2004_CuAgAuNiPdPtAlPbFeMoTaWMgCoTiZr__MO_870117231765_000
==== 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 14:06:47       -8.785896         0.960644
BFGS:    1 14:06:47       -8.812293         0.826076
BFGS:    2 14:06:47       -8.864636         0.143284
BFGS:    3 14:06:47       -8.865899         0.171062
BFGS:    4 14:06:47       -8.866333         0.151007
BFGS:    5 14:06:47       -8.867875         0.001998
BFGS:    6 14:06:47       -8.867876         0.000092
BFGS:    7 14:06:47       -8.867876         0.000000
BFGS:    8 14:06:47       -8.867876         0.000000
Minimization converged after 8 steps.
Maximum force component: 2.5503318550330715e-33 eV/Angstrom
Maximum stress component: 4.3307499675782963e-10 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([[2.4828900148330346, 6.988610539325997e-18, -5.215267364524913e-37], [-1.2414450074165173, 2.150245827648128, -6.11396504211271e-38], [-3.607782871056579e-38, -7.555163766726816e-36, 4.11681067779535]])
forces =  [[-2.55033186e-33 -7.17843963e-51  5.35692778e-70]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]]
stress =  [ 1.40690827e-10  1.40690827e-10  4.33074997e-10 -2.59480132e-45
 -9.18566522e-46 -2.91311171e-26]
energy per atom =  -4.433937803245204
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0