element(s):
['Sr']
AFLOW prototype label:
A_cP1_221_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.8303']
model name:
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003
==== Building ASE atoms object with: ====
representative atom symbols =  ['Sr']
representative atom coordinates =  [[0 0 0]]
spacegroup =  221
cell =  [[3.8303, 0, 0], [0, 3.8303, 0], [0, 0, 3.8303]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 17:31:20       -0.712022         0.419154
BFGS:    1 17:31:21       -0.719018         0.358220
BFGS:    2 17:31:21       -0.729911         0.225176
BFGS:    3 17:31:21       -0.733103         0.051048
BFGS:    4 17:31:21       -0.733315         0.004732
BFGS:    5 17:31:21       -0.733319         0.006332
BFGS:    6 17:31:21       -0.733308         0.013189
BFGS:    7 17:31:21       -0.733322         0.000047
BFGS:    8 17:31:21       -0.733322         0.000000
BFGS:    9 17:31:21       -0.733322         0.000000
Minimization converged after 9 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.7468402266685e-13 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Sr']
basis =  [[0. 0. 0.]]
cellpar =  Cell([[3.7127024983715593, 1.0088282779773866e-32, -1.9893652155370868e-34], [-1.5379795677824348e-32, 3.7127024983715593, 1.1640262902453728e-17], [1.022746763673701e-33, 1.1640262902453726e-17, 3.7127024983715593]])
forces =  [[0. 0. 0.]]
stress =  [-1.74684023e-13 -1.74684023e-13 -1.74684023e-13  5.17486973e-30
  1.45542206e-37 -3.64924018e-54]
energy per atom =  -0.7333218815726291
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0