element(s):
['Si']
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:
['2.6513', '0.93471127']
model name:
Sim_LAMMPS_Vashishta_NakanoKaliaVashishta_1994_SiO__SM_503555646986_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Si']
representative atom coordinates =  [[0 0 0]]
spacegroup =  191
cell =  [[2.6513, 0, 0], [-1.32565, 2.2960931530537, 0], [0, 0, 2.4782]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 14:40:37       26.259135       35.0682
BFGS:    1 14:40:37       21.654030       27.8009
BFGS:    2 14:40:37       18.593994       23.8530
BFGS:    3 14:40:37       15.582548       20.1785
BFGS:    4 14:40:37       13.084451       17.0689
BFGS:    5 14:40:37       11.047734       14.5407
BFGS:    6 14:40:37        9.274358       12.6532
BFGS:    7 14:40:37        7.615973       10.7731
BFGS:    8 14:40:37        6.198273        9.0440
BFGS:    9 14:40:37        5.057406        7.5291
BFGS:   10 14:40:37        4.143229        6.1885
BFGS:   11 14:40:37        3.419318        4.9931
BFGS:   12 14:40:37        2.839174        4.2267
BFGS:   13 14:40:37        2.328021        3.6240
BFGS:   14 14:40:37        1.876232        3.0785
BFGS:   15 14:40:37        1.481086        2.6058
BFGS:   16 14:40:37        1.139744        2.3020
BFGS:   17 14:40:37        0.849352        2.0071
BFGS:   18 14:40:37        0.607114        1.7226
BFGS:   19 14:40:37        0.411184        1.4499
BFGS:   20 14:40:37        0.264436        1.2000
BFGS:   21 14:40:37        0.159114        0.9705
BFGS:   22 14:40:37        0.088523        0.7593
BFGS:   23 14:40:37        0.046542        0.5646
BFGS:   24 14:40:37        0.022783        0.3848
BFGS:   25 14:40:37        0.007750        0.2186
BFGS:   26 14:40:37        0.000715        0.0647
BFGS:   27 14:40:37        0.000002        0.0034
BFGS:   28 14:40:37        0.000000        0.0001
BFGS:   29 14:40:37        0.000000        0.0000
BFGS:   30 14:40:37       -0.000000        0.0000
Minimization converged after 30 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.010157473149439e-14 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Si']
basis =  [[0. 0. 0.]]
cellpar =  Cell([[5.7898433414865265, -8.655572023635111e-17, 6.949936396773847e-34], [-2.8949216707432632, 5.014151417659514, 1.5289289398565418e-33], [1.3756450630528627e-33, 4.5017807189185794e-33, 5.499999999999372]])
forces =  [[0. 0. 0.]]
stress =  [-9.45352795e-81 -2.03817539e-80 -1.01015747e-14 -1.12389703e-47
 -3.99025846e-48 -4.43954507e-81]
energy per atom =  -8.881784197001252e-16
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0