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:
Morse_Shifted_GirifalcoWeizer_1959LowCutoff_Mo__MO_228581001644_004
==== 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 17:52:56       -5.323578         4.413591
BFGS:    1 17:52:56       -5.419927         0.532978
BFGS:    2 17:52:56       -5.422839         0.105261
BFGS:    3 17:52:56       -5.422934         0.004790
BFGS:    4 17:52:56       -5.422935         0.000077
BFGS:    5 17:52:56       -5.422935         0.000001
BFGS:    6 17:52:56       -5.422935         0.000000
Minimization converged after 6 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.8669057917940756e-13 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Mo']
basis =  [[0. 0. 0.]]
cellpar =  Cell([[2.7534560110308366, 1.489917528980193e-17, 3.2415071251722256e-38], [-1.3767280055154183, 2.384562853755671, 4.477432195675644e-38], [2.9437272907105438e-36, -4.2123173447132865e-35, 2.6369384360372847]])
forces =  [[0. 0. 0.]]
stress =  [-7.09071597e-14 -7.09071597e-14 -1.86690579e-13  7.69346895e-38
 -1.43051720e-37 -1.63472783e-29]
energy per atom =  -5.422934838654782
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0