element(s):
['P']
AFLOW prototype label:
A_hR2_166_c
Parameter names:
['a', 'c/a', 'x1']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.4783467', '2.6477103', '0.7708377']
model name:
MEAM_LAMMPS_KoJimLee_2012_FeP__MO_179420363944_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['P']
representative atom coordinates =  [[0.        0.        0.2708377]]
spacegroup =  166
cell =  [[3.4783, 0, 0], [-1.73915, 3.0122961619834, 0], [0, 0, 9.2097]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:07:38      -18.867674         1.975218
BFGS:    1 16:07:38      -19.186334         1.700558
BFGS:    2 16:07:38      -19.629576         1.200045
BFGS:    3 16:07:38      -19.920426         0.681877
BFGS:    4 16:07:38      -20.059001         0.501460
BFGS:    5 16:07:38      -20.075557         0.462379
BFGS:    6 16:07:38      -20.082900         0.426521
BFGS:    7 16:07:38      -20.108172         0.264984
BFGS:    8 16:07:38      -20.123767         0.113746
BFGS:    9 16:07:38      -20.127052         0.055324
BFGS:   10 16:07:38      -20.127438         0.049726
BFGS:   11 16:07:38      -20.127589         0.054641
BFGS:   12 16:07:38      -20.128130         0.065413
BFGS:   13 16:07:38      -20.129242         0.076188
BFGS:   14 16:07:38      -20.131587         0.082141
BFGS:   15 16:07:38      -20.134214         0.073974
BFGS:   16 16:07:38      -20.136494         0.058152
BFGS:   17 16:07:38      -20.138033         0.022094
BFGS:   18 16:07:38      -20.138208         0.005121
BFGS:   19 16:07:38      -20.138225         0.000459
BFGS:   20 16:07:38      -20.138225         0.000070
BFGS:   21 16:07:38      -20.138225         0.000005
BFGS:   22 16:07:38      -20.138225         0.000000
BFGS:   23 16:07:38      -20.138225         0.000000
BFGS:   24 16:07:38      -20.138225         0.000000
Minimization converged after 24 steps.
Maximum force component: 2.213328779513783e-10 eV/Angstrom
Maximum stress component: 8.258828327492413e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['P', 'P', 'P', 'P', 'P', 'P']
basis =  [[3.24502819e-32 6.49005638e-32 2.50000000e-01]
 [1.68921811e-17 3.37843622e-17 7.50000000e-01]
 [6.66666667e-01 3.33333333e-01 5.83333333e-01]
 [6.66666667e-01 3.33333333e-01 8.33333333e-02]
 [3.33333333e-01 6.66666667e-01 9.16666667e-01]
 [3.33333333e-01 6.66666667e-01 4.16666667e-01]]
cellpar =  Cell([[3.508822030250241, -9.567700653651114e-18, 1.7067951208673035e-16], [-1.7544110151251204, 3.0387290155552, 3.427250255912177e-16], [4.449620424130228e-16, 8.403806499709698e-16, 8.594823572382337]])
forces =  [[ 1.14587684e-26  2.16413246e-26  2.21332878e-10]
 [-1.14586987e-26 -2.16412664e-26 -2.21332878e-10]
 [ 1.14587251e-26  2.16413829e-26  2.21332878e-10]
 [-1.14586482e-26 -2.16413163e-26 -2.21332878e-10]
 [ 1.14586867e-26  2.16413496e-26  2.21332878e-10]
 [-1.14586386e-26 -2.16413496e-26 -2.21332878e-10]]
stress =  [ 8.21645718e-11  8.21645718e-11  8.25882833e-11 -4.45344676e-25
 -1.55729790e-25  9.82248226e-27]
energy per atom =  -3.356370827987396
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Prototype label changed during relaxation: test template prototype is A_hR2_166_c, while relaxed is A_cP1_221_a. Skipping parameter set 0.
No parameter sets in this group successfully added a property instance. Skipping this group.