element(s):
['Al']
AFLOW prototype label:
A_cI2_229_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.233']
model name:
EAM_Dynamo_FarkasJones_1996_NbTiAl__MO_042691367780_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Al']
representative atom coordinates =  [[0 0 0]]
spacegroup =  229
cell =  [[3.233, 0, 0], [0, 3.233, 0], [0, 0, 3.233]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 13:54:12       -5.952219        1.8377
BFGS:    1 13:54:12       -6.082791        1.4581
BFGS:    2 13:54:12       -6.240771        0.6058
BFGS:    3 13:54:12       -6.264795        0.1853
BFGS:    4 13:54:12       -6.266878        0.0166
BFGS:    5 13:54:12       -6.266896        0.0004
BFGS:    6 13:54:12       -6.266896        0.0000
BFGS:    7 13:54:12       -6.266896        0.0000
Minimization converged after 7 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 3.596854169359052e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Al', 'Al']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[3.0646121944889737, 1.867595638972452e-33, -1.873826449819193e-35], [2.6724449231707027e-33, 3.0646121944889737, -2.201739141355876e-17], [-9.80517649736444e-34, -2.2017391413558762e-17, 3.0646121944889737]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [3.59685417e-12 3.59685417e-12 3.59685417e-12 3.17538717e-29
 3.72637194e-61 3.42438892e-61]
energy per atom =  -3.133447799549002
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0