element(s):
['Al']
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:
['4.039']
model name:
MEAM_LAMMPS_MahataMukhopadhyayAsleZaeem_2022_AlNi__MO_461927113651_001
==== Building ASE atoms object with: ====
representative atom symbols =  ['Al']
representative atom coordinates =  [[0 0 0]]
spacegroup =  225
cell =  [[4.039, 0, 0], [0, 4.039, 0], [0, 0, 4.039]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 13:54:34      -13.439816        0.0362
BFGS:    1 13:54:34      -13.439870        0.0332
BFGS:    2 13:54:34      -13.440157        0.0004
BFGS:    3 13:54:35      -13.440157        0.0000
BFGS:    4 13:54:35      -13.440157        0.0000
Minimization converged after 4 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 3.5182640680348325e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Al', 'Al', 'Al', 'Al']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [0.00000000e+00 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 2.90578913e-39]]
cellpar =  Cell([[4.045353245653133, -3.026694156333853e-40, -1.3701848726305403e-33], [2.4219760794701952e-40, 4.045353245653133, -1.7025333512863179e-22], [-8.593085258366129e-33, -1.7025333512761717e-22, 4.045353245653133]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-3.51826407e-11 -3.51826407e-11 -3.51826407e-11  7.81211563e-27
  7.84578359e-36 -1.27660713e-60]
energy per atom =  -3.3600391863151535
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0