element(s):
['Li']
AFLOW prototype label:
A_hP1_191_a
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:
['2.9353', '0.92505025']
model name:
MEAM_LAMMPS_RoyDuttaChakraborti_2021_AlLi__MO_971738391444_001
==== Building ASE atoms object with: ====
representative atom symbols =  ['Li']
representative atom coordinates =  [[0 0 0]]
spacegroup =  191
cell =  [[2.9353, 0, 0], [-1.46765, 2.5420443677285, 0], [0, 0, 2.7153]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 14:37:39       -1.604168        0.3867
BFGS:    1 14:37:39       -1.607308        0.3615
BFGS:    2 14:37:39       -1.625695        0.1619
BFGS:    3 14:37:39       -1.629232        0.0623
BFGS:    4 14:37:39       -1.629420        0.0427
BFGS:    5 14:37:39       -1.629551        0.0451
BFGS:    6 14:37:39       -1.629850        0.0407
BFGS:    7 14:37:39       -1.630115        0.0242
BFGS:    8 14:37:39       -1.630231        0.0078
BFGS:    9 14:37:39       -1.630249        0.0025
BFGS:   10 14:37:39       -1.630251        0.0002
BFGS:   11 14:37:39       -1.630251        0.0000
BFGS:   12 14:37:39       -1.630251        0.0000
BFGS:   13 14:37:39       -1.630251        0.0000
Minimization converged after 13 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 2.4252699357518185e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Li']
basis =  [[0. 0. 0.]]
cellpar =  Cell([[3.0359251665082243, 1.409457961666438e-17, -2.2018505273258128e-36], [-1.5179625832541122, 2.6291883181846236, 1.2474809805468238e-36], [-2.4574960113208365e-35, -1.5048404864957674e-35, 3.0176730473686657]])
forces =  [[0. 0. 0.]]
stress =  [-3.33878676e-11 -3.33878676e-11 -2.42526994e-10 -2.99746759e-46
 -4.98638510e-46  4.82423257e-27]
energy per atom =  -1.6302507764323677
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0