element(s):
['P']
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:
['2.442']
model name:
Sim_LAMMPS_Vashishta_BranicioRinoGan_2009_InP__SM_090647175366_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['P']
representative atom coordinates =  [[0 0 0]]
spacegroup =  221
cell =  [[2.442, 0, 0], [0, 2.442, 0], [0, 0, 2.442]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 14:16:18       26.585094       46.3684
BFGS:    1 14:16:18       20.643305       33.6774
BFGS:    2 14:16:18       16.300483       24.7336
BFGS:    3 14:16:18       13.036647       19.0798
BFGS:    4 14:16:18       10.503771       14.8904
BFGS:    5 14:16:18        8.517222       11.7819
BFGS:    6 14:16:18        6.930854        9.4626
BFGS:    7 14:16:18        5.654746        7.6192
BFGS:    8 14:16:18        4.627818        6.1227
BFGS:    9 14:16:18        3.799155        5.0082
BFGS:   10 14:16:18        3.114550        4.1452
BFGS:   11 14:16:18        2.548921        3.4161
BFGS:   12 14:16:18        2.084474        2.7920
BFGS:   13 14:16:18        1.707151        2.2515
BFGS:   14 14:16:18        1.405655        1.7787
BFGS:   15 14:16:18        1.169798        1.4124
BFGS:   16 14:16:18        0.971890        1.2303
BFGS:   17 14:16:18        0.799627        1.0698
BFGS:   18 14:16:18        0.650069        0.9270
BFGS:   19 14:16:18        0.520766        0.7993
BFGS:   20 14:16:18        0.409646        0.6843
BFGS:   21 14:16:18        0.314942        0.5801
BFGS:   22 14:16:18        0.235132        0.4855
BFGS:   23 14:16:19        0.168894        0.3990
BFGS:   24 14:16:19        0.115069        0.3198
BFGS:   25 14:16:19        0.072636        0.2470
BFGS:   26 14:16:19        0.040687        0.1799
BFGS:   27 14:16:19        0.018416        0.1179
BFGS:   28 14:16:19        0.005096        0.0604
BFGS:   29 14:16:19        0.000075        0.0072
BFGS:   30 14:16:19        0.000000        0.0003
BFGS:   31 14:16:19        0.000000        0.0000
BFGS:   32 14:16:19       -0.000000        0.0000
Minimization converged after 32 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 3.550061213017802e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['P']
basis =  [[0. 0. 0.]]
cellpar =  Cell([[5.999999999250417, 4.31820085898298e-32, 2.444345542175669e-32], [1.1328661511479747e-31, 5.999999999250417, -3.191152219284522e-16], [-1.281884206875536e-31, -3.1911522192845215e-16, 5.999999999250417]])
forces =  [[0. 0. 0.]]
stress =  [-3.55006121e-12 -3.55006121e-12 -3.55006121e-12 -3.57380329e-28
 -3.31445845e-45  7.26897526e-60]
energy per atom =  -1.3322676295501878e-15
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0