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:
MEAM_LAMMPS_WangOhLee_2020_CuMo__MO_486450342170_002
==== 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 17:53:16       -5.645144         0.572484
BFGS:    1 17:53:16       -5.651960         0.202868
BFGS:    2 17:53:16       -5.653344         0.085750
BFGS:    3 17:53:16       -5.653435         0.029709
BFGS:    4 17:53:16       -5.653449         0.000351
BFGS:    5 17:53:16       -5.653449         0.000001
BFGS:    6 17:53:16       -5.653449         0.000000
Minimization converged after 6 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 3.681780877966725e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Mo']
basis =  [[0. 0. 0.]]
cellpar =  Cell([[2.743271770411593, 8.320343254390178e-19, -4.936156425817251e-37], [-1.3716358852057966, 2.3757430426611523, 3.920729803557429e-37], [-9.152551622398977e-37, -3.910460738034928e-36, 2.5511388413376626]])
forces =  [[0. 0. 0.]]
stress =  [ 3.68178088e-10  3.68178088e-10  8.32577665e-11 -3.24195768e-40
  5.58239470e-40  4.43382030e-26]
energy per atom =  -5.653448891417959
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0