element(s):
['Li']
AFLOW prototype label:
A_hR1_166_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:
['3.0399777', '2.4670212']
model name:
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003
==== Building ASE atoms object with: ====
representative atom symbols =  ['Li']
representative atom coordinates =  [[0 0 0]]
spacegroup =  166
cell =  [[3.04, 0, 0], [-1.52, 2.6327172275047, 0], [0, 0, 7.4997]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 15:51:40      -13.152765        7.3536
BFGS:    1 15:51:40      -14.297459        7.9215
BFGS:    2 15:51:40      -15.524523        8.4509
BFGS:    3 15:51:40      -16.825234        8.9508
BFGS:    4 15:51:40      -18.191951        9.3993
BFGS:    5 15:51:40      -19.604124        9.6856
BFGS:    6 15:51:40      -21.031607        9.7613
BFGS:    7 15:51:40      -22.437650        9.5211
BFGS:    8 15:51:40      -23.747158        8.7740
BFGS:    9 15:51:40      -24.888151        7.3581
BFGS:   10 15:51:40      -25.751852        4.9179
BFGS:   11 15:51:40      -26.195116        1.1829
BFGS:   12 15:51:40      -26.213533        0.4331
BFGS:   13 15:51:40      -26.215713        0.0225
BFGS:   14 15:51:40      -26.215718        0.0010
BFGS:   15 15:51:40      -26.215718        0.0002
BFGS:   16 15:51:40      -26.215718        0.0000
BFGS:   17 15:51:40      -26.215718        0.0000
BFGS:   18 15:51:40      -26.215718        0.0000
Minimization converged after 18 steps.
Maximum force component: 5.344951279196782e-31 eV/Angstrom
Maximum stress component: 5.900569925066234e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Li', 'Li', 'Li']
basis =  [[0.00000000e+00 5.13581319e-34 0.00000000e+00]
 [6.66666667e-01 3.33333333e-01 3.33333333e-01]
 [3.33333333e-01 6.66666667e-01 6.66666667e-01]]
cellpar =  Cell([[2.4894889416872346, -2.816098888130568e-16, -1.5712385001081415e-15], [-1.2447444708436175, 2.1559606659415818, -4.367933800667802e-15], [-4.248911197286268e-15, -1.4532422886032853e-14, 6.097977627538]])
forces =  [[-1.36379201e-32 -2.36215706e-32 -5.34495128e-31]
 [-1.36379201e-32 -2.36215706e-32 -2.67247564e-31]
 [-1.36379201e-32 -2.36215706e-32 -5.34495128e-31]]
stress =  [-5.90056993e-10 -5.90056993e-10 -4.13810229e-10 -2.79518765e-24
  2.02125036e-26  4.59425281e-25]
energy per atom =  -8.738572831054618
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Prototype label changed during relaxation: test template prototype is A_hR1_166_a, while relaxed is A_cF4_225_a. Skipping parameter set 0.
No parameter sets in this group successfully added a property instance. Skipping this group.