element(s):
['Y']
AFLOW prototype label:
A_hP2_194_c
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:
['3.6555', '1.5493093']
model name:
MEAM_LAMMPS_KoLee_2013_VPdY__MO_046547823135_002
==== Building ASE atoms object with: ====
representative atom symbols =  ['Y']
representative atom coordinates =  [[0.33333333 0.66666667 0.25      ]]
spacegroup =  194
cell =  [[3.6555, 0, 0], [-1.82775, 3.165755863534, 0], [0, 0, 5.6635]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 14:14:55       -8.737506         0.240941
BFGS:    1 14:14:55       -8.738334         0.209048
BFGS:    2 14:14:55       -8.740680         0.063928
BFGS:    3 14:14:55       -8.740824         0.063111
BFGS:    4 14:14:55       -8.741327         0.030101
BFGS:    5 14:14:55       -8.741398         0.010775
BFGS:    6 14:14:55       -8.741408         0.001415
BFGS:    7 14:14:55       -8.741409         0.000070
BFGS:    8 14:14:55       -8.741409         0.000003
BFGS:    9 14:14:55       -8.741409         0.000000
BFGS:   10 14:14:55       -8.741409         0.000000
Minimization converged after 10 steps.
Maximum force component: 5.6181754383021484e-33 eV/Angstrom
Maximum stress component: 1.251633274708775e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Y', 'Y']
basis =  [[0.33333333 0.66666667 0.25      ]
 [0.66666666 0.33333334 0.75      ]]
cellpar =  Cell([[3.6464043348742217, 4.778023843454998e-18, 5.999666267320124e-39], [-1.8232021674371108, 3.157878786470775, 1.3921072514097696e-38], [-7.661572501191101e-39, 1.1901801268887638e-36, 5.761808616768982]])
forces =  [[-1.40454386e-33  2.43274133e-33  1.07244042e-71]
 [ 5.61817544e-33 -3.24365510e-33 -8.13657253e-72]]
stress =  [-2.08270322e-12 -2.08270322e-12 -1.25163327e-11  6.77432729e-34
  3.91115968e-34 -1.76938213e-28]
energy per atom =  -4.370704287412698
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0