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:
Sim_LAMMPS_MEAM_PascuetFernandez_2015_Al__SM_811588957187_000
==== 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 15:12:41      -13.438860         0.067710
BFGS:    1 15:12:41      -13.439048         0.061606
BFGS:    2 15:12:41      -13.439960         0.000992
BFGS:    3 15:12:41      -13.439960         0.000017
BFGS:    4 15:12:41      -13.439960         0.000000
Minimization converged after 4 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 3.0005360477235244e-10 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 4.75538389e-35]]
cellpar =  Cell([[4.049998886140711, 9.642625902495349e-33, -1.2330130183648833e-32], [1.1951867522187394e-32, 4.049998886140711, -2.2188741349764507e-18], [-1.0438529973691211e-33, -2.2188741349764634e-18, 4.049998886140711]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-3.00053605e-10 -3.00053605e-10 -3.00053605e-10  4.73987438e-26
  2.54403323e-35 -1.98225761e-51]
energy per atom =  -3.359989957384301
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0