element(s):
['Mo']
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:
['2.7779', '0.90949998']
model name:
SNAP_ZuoChenLi_2019_Mo__MO_014123846623_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Mo']
representative atom coordinates =  [[0 0 0]]
spacegroup =  191
cell =  [[2.7779, 0, 0], [-1.38895, 2.4057319691728, 0], [0, 0, 2.5265]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:53:50       -9.785439         2.611407
BFGS:    1 16:53:50       -9.872279         1.595543
BFGS:    2 16:53:50       -9.891663         0.313798
BFGS:    3 16:53:50       -9.892588         0.025196
BFGS:    4 16:53:50       -9.892593         0.001556
BFGS:    5 16:53:50       -9.892593         0.000195
BFGS:    6 16:53:50       -9.892593         0.000004
BFGS:    7 16:53:50       -9.892593         0.000000
BFGS:    8 16:53:50       -9.892593         0.000000
Minimization converged after 8 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 2.0286085211715955e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Mo']
basis =  [[0. 0. 0.]]
cellpar =  Cell([[2.7077905030938476, 3.354941006008007e-17, -2.9967746713232983e-38], [-1.3538952515469238, 2.3450153638055182, 4.3243626959803945e-38], [-1.0511110566311726e-35, 1.2989939774960833e-35, 2.45538543155905]])
forces =  [[0. 0. 0.]]
stress =  [ 2.02860852e-10  2.02860852e-10 -3.15470513e-12 -6.31127987e-36
 -1.09314574e-35  1.00384156e-26]
energy per atom =  -4.53798757552865
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0