element(s):
['Li']
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:
['4.3176']
model name:
SNAP_ZuoChenLi_2019quadratic_Li__MO_041269750353_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Li']
representative atom coordinates =  [[0 0 0]]
spacegroup =  225
cell =  [[4.3176, 0, 0], [0, 4.3176, 0], [0, 0, 4.3176]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 17:02:31       -7.603220        0.1293
BFGS:    1 17:02:31       -7.603926        0.1255
BFGS:    2 17:02:31       -7.613334        0.0105
BFGS:    3 17:02:31       -7.613382        0.0023
BFGS:    4 17:02:31       -7.613384        0.0000
BFGS:    5 17:02:31       -7.613384        0.0000
BFGS:    6 17:02:31       -7.613384        0.0000
Minimization converged after 6 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.3838580523862454e-13 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Li', 'Li', 'Li', 'Li']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [1.20319725e-49 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]]
cellpar =  Cell([[4.265059816869771, -7.542823244000911e-35, -2.0386269508076476e-33], [1.4492664877685484e-33, 4.265059816869771, 6.500644859852513e-19], [-8.324191686170101e-33, 6.500644859852736e-19, 4.265059816869771]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 1.38385805e-13  1.38385805e-13  1.38385805e-13 -2.21034246e-29
  2.73508407e-35  1.20580003e-51]
energy per atom =  -0.5548963641299822
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0