element(s):
['Al', 'Pd']
AFLOW prototype label:
AB_cP2_221_a_b
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.0717']
model name:
EAM_IMD_SchopfBrommerFrigan_2012_AlMnPd__MO_878712978062_003
==== Building ASE atoms object with: ====
representative atom symbols =  ['Al', 'Pd']
representative atom coordinates =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
spacegroup =  221
cell =  [[3.0717, 0, 0], [0, 3.0717, 0], [0, 0, 3.0717]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 14:43:09      -10.888276        1.1175
BFGS:    1 14:43:09      -10.933022        0.7500
BFGS:    2 14:43:09      -10.968937        0.0247
BFGS:    3 14:43:09      -10.968974        0.0014
BFGS:    4 14:43:09      -10.968974        0.0000
BFGS:    5 14:43:09      -10.968974        0.0000
Minimization converged after 5 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.591899850192518e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Al', 'Pd']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.998656485196518, -1.0540746194464742e-35, 8.456301397202792e-33], [5.508892678783201e-35, 2.998656485196518, 4.138684350094541e-19], [-1.4148248437050386e-33, 4.1386843500946647e-19, 2.998656485196518]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-1.59189985e-10 -1.59189985e-10 -1.59189985e-10  1.42452890e-25
  4.56925894e-34 -2.04255083e-49]
energy per atom =  -5.484486839206903
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0