element(s):
['Cu', 'Pt']
AFLOW prototype label:
A3B_cP4_221_c_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.7123']
model name:
EMT_Asap_Standard_JacobsenStoltzeNorskov_1996_AlAgAuCuNiPdPt__MO_115316750986_001
==== Building ASE atoms object with: ====
representative atom symbols =  ['Cu', 'Pt']
representative atom coordinates =  [[0.  0.5 0.5]
 [0.  0.  0. ]]
spacegroup =  221
cell =  [[3.7123, 0, 0], [0, 3.7123, 0], [0, 0, 3.7123]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 10:32:02      -16.719439         0.627866
BFGS:    1 10:32:02      -16.735327         0.552770
BFGS:    2 10:32:02      -16.785213         0.103296
BFGS:    3 10:32:03      -16.786864         0.008010
BFGS:    4 10:32:03      -16.786874         0.000106
BFGS:    5 10:32:03      -16.786874         0.000000
BFGS:    6 10:32:03      -16.786874         0.000000
Minimization converged after 6 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.1295024007769781e-13 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Cu', 'Cu', 'Cu', 'Pt']
basis =  [[0.00000000e+00 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 5.98132169e-17 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 5.98132169e-17]
 [0.00000000e+00 5.98132169e-17 5.98132169e-17]]
cellpar =  Cell([[3.647665003821459, -2.8279064717583686e-33, 7.861373178691605e-33], [-6.493585669561861e-33, 3.647665003821459, 1.7018442993692589e-19], [-2.4513702057136088e-33, 1.7018442993692779e-19, 3.647665003821459]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-1.12950240e-13 -1.12950240e-13 -1.12950240e-13  4.25218711e-30
  4.51857260e-62 -3.48905284e-62]
energy per atom =  -4.196718559938407
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0