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_RoyDuttaChakraborti_2021_AlLi__MO_971738391444_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 09:45:47      -13.410926        0.0660
BFGS:    1 09:45:47      -13.411104        0.0602
BFGS:    2 09:45:47      -13.412000        0.0007
BFGS:    3 09:45:47      -13.412000        0.0000
BFGS:    4 09:45:47      -13.412000        0.0000
Minimization converged after 4 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 7.361675557202969e-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 9.51076519e-35 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 4.75538259e-35]]
cellpar =  Cell([[4.049999988209401, 1.0927151414210428e-33, 8.777542105706544e-36], [-1.6774067211484213e-34, 4.049999988209401, 2.2037314449255793e-18], [-1.820250042199063e-33, 2.2037314449255805e-18, 4.049999988209401]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-7.36167556e-11 -7.36167556e-11 -7.36167556e-11  3.00314840e-26
 -1.56555806e-35  3.24771140e-51]
energy per atom =  -3.3530000001174116
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0