element(s):
['Zn']
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:
['2.6771', '1.7211908']
model name:
MEAM_LAMMPS_JangSeolLee_2019_CaZnMg__MO_708495328010_001
==== Building ASE atoms object with: ====
representative atom symbols =  ['Zn']
representative atom coordinates =  [[0.33333333 0.66666667 0.25      ]]
spacegroup =  194
cell =  [[2.6771, 0, 0], [-1.33855, 2.3184366084713, 0], [0, 0, 4.6078]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:02:51       -2.136753         0.636230
BFGS:    1 16:02:51       -2.147339         0.527861
BFGS:    2 16:02:51       -2.174663         0.181390
BFGS:    3 16:02:51       -2.176515         0.193531
BFGS:    4 16:02:51       -2.177495         0.182309
BFGS:    5 16:02:51       -2.178753         0.138699
BFGS:    6 16:02:51       -2.179884         0.060244
BFGS:    7 16:02:51       -2.180311         0.025019
BFGS:    8 16:02:51       -2.180397         0.003541
BFGS:    9 16:02:51       -2.180401         0.000537
BFGS:   10 16:02:51       -2.180401         0.000022
BFGS:   11 16:02:51       -2.180401         0.000000
BFGS:   12 16:02:51       -2.180401         0.000000
Minimization converged after 12 steps.
Maximum force component: 5.706639157837046e-33 eV/Angstrom
Maximum stress component: 5.882237966772456e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Zn', 'Zn']
basis =  [[0.33333333 0.66666667 0.25      ]
 [0.66666666 0.33333334 0.75      ]]
cellpar =  Cell([[2.777865428627731, -3.3815651721495224e-17, -4.881301695394968e-37], [-1.3889327143138654, 2.4057020294861626, -8.020182088399017e-37], [-1.947764595339733e-36, 9.250952308271699e-36, 4.498084366046064]])
forces =  [[ 5.70663916e-33 -2.47104724e-33  7.17195301e-71]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]]
stress =  [-5.88223797e-11 -5.88223797e-11  3.98235633e-11  1.89845269e-34
  2.15767548e-46 -1.51456704e-26]
energy per atom =  -1.0902006082017426
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0