element(s):
['Pt', 'V']
AFLOW prototype label:
AB_tP2_123_a_d
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:
['2.702', '1.4529608']
model name:
MEAM_LAMMPS_KimSeolJi_2017_PtV__MO_912978207512_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['Pt', 'V']
representative atom coordinates =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
spacegroup =  123
cell =  [[2.702, 0, 0], [0, 2.702, 0], [0, 0, 3.9259]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 21:44:04      -12.155214         1.030413
BFGS:    1 21:44:04      -12.168912         0.815533
BFGS:    2 21:44:04      -12.194758         0.509652
BFGS:    3 21:44:04      -12.203966         0.500888
BFGS:    4 21:44:04      -12.209263         0.359609
BFGS:    5 21:44:04      -12.211786         0.050318
BFGS:    6 21:44:05      -12.211842         0.002515
BFGS:    7 21:44:05      -12.211842         0.000058
BFGS:    8 21:44:05      -12.211842         0.000000
BFGS:    9 21:44:05      -12.211842         0.000000
Minimization converged after 9 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 4.6031458043934444e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Pt', 'V']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[2.735242936502537, -2.1160476207340646e-35, -3.959542674908788e-32], [4.868578429070757e-36, 2.735242936502537, -2.304540023107226e-17], [-1.6075379035243236e-32, -3.2074630782981477e-17, 3.7488140048418166]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [-4.60314580e-10 -4.60314580e-10  1.59083234e-10 -3.72960315e-26
 -3.75647688e-35  8.80681618e-51]
energy per atom =  -6.1059212453784335
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0