element(s):
['U']
AFLOW prototype label:
A_cF4_225_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['5.0848']
model name:
Sim_LAMMPS_ADP_StarikovKolotovaKuksin_2017_UMo__SM_682749584055_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['U']
representative atom coordinates =  [[0 0 0]]
spacegroup =  225
cell =  [[5.0848, 0, 0], [0, 5.0848, 0], [0, 0, 5.0848]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:33:58      -13.779454         3.516935
BFGS:    1 15:33:58      -14.282761         2.980885
BFGS:    2 15:33:58      -14.663946         2.096709
BFGS:    3 15:33:58      -14.910018         1.188161
BFGS:    4 15:33:58      -15.021783         0.303867
BFGS:    5 15:33:58      -15.029654         0.001427
BFGS:    6 15:33:58      -15.029655         0.000001
BFGS:    7 15:33:58      -15.029655         0.000000
Minimization converged after 7 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 5.022514103943771e-13 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['U', 'U', 'U', 'U']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [7.11460166e-50 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]]
cellpar =  Cell([[4.8086161306453565, 2.798123107057475e-32, 5.520550205453976e-34], [5.3400196010916866e-33, 4.8086161306453565, 1.1331762400344512e-17], [1.8661341651946923e-32, 1.1331762400344515e-17, 4.8086161306453565]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 5.02251410e-13  5.02251410e-13  5.02251410e-13 -1.34684432e-29
 -5.55276135e-36 -3.95207434e-52]
energy per atom =  -3.757413656001962
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0