element(s):
['Li']
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:
['3.0565', '1.639326']
model name:
MEAM_LAMMPS_RoyDuttaChakraborti_2021_AlLi__MO_971738391444_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Li']
representative atom coordinates =  [[0.33333333 0.66666667 0.25      ]]
spacegroup =  194
cell =  [[3.0565, 0, 0], [-1.52825, 2.6470066466671, 0], [0, 0, 5.0106]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 10:57:05       -3.301836         0.318223
BFGS:    1 10:57:05       -3.305945         0.302131
BFGS:    2 10:57:05       -3.337633         0.138144
BFGS:    3 10:57:05       -3.346761         0.019066
BFGS:    4 10:57:05       -3.346913         0.003768
BFGS:    5 10:57:06       -3.346914         0.004815
BFGS:    6 10:57:06       -3.346915         0.005071
BFGS:    7 10:57:06       -3.346918         0.005428
BFGS:    8 10:57:06       -3.346923         0.004794
BFGS:    9 10:57:06       -3.346928         0.002649
BFGS:   10 10:57:06       -3.346930         0.000823
BFGS:   11 10:57:06       -3.346930         0.000157
BFGS:   12 10:57:06       -3.346930         0.000016
BFGS:   13 10:57:07       -3.346930         0.000001
BFGS:   14 10:57:07       -3.346930         0.000000
BFGS:   15 10:57:07       -3.346930         0.000000
Minimization converged after 15 steps.
Maximum force component: 1.0771183856913453e-32 eV/Angstrom
Maximum stress component: 1.8075433259540368e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Li', 'Li']
basis =  [[0.33333333 0.66666667 0.25      ]
 [0.66666666 0.33333334 0.75      ]]
cellpar =  Cell([[3.216316369545008, -5.439399680694515e-17, 5.852014075157352e-40], [-1.608158184772504, 2.7854116826337165, -6.912775130933161e-40], [-2.6784348601225337e-38, -2.308117557770491e-37, 5.243173509651823]])
forces =  [[-4.95552001e-33  2.86107081e-33 -1.07711839e-32]
 [-5.50237643e-71 -4.74162423e-70  1.07711839e-32]]
stress =  [-1.80754333e-11 -1.80754333e-11 -1.99091981e-12  2.10997275e-34
  1.21819333e-34  1.53843602e-27]
energy per atom =  -1.673465211174765
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0