element(s):
['N']
AFLOW prototype label:
A_tP4_136_f
Parameter names:
['a', 'c/a', 'x1']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.2482', '1.3389436', '0.092623864']
model name:
SW_BereSerra_2006_GaN__MO_861114678890_001
==== Building ASE atoms object with: ====
representative atom symbols =  ['N']
representative atom coordinates =  [[0.09262386 0.09262386 0.        ]]
spacegroup =  136
cell =  [[4.2482, 0, 0], [0, 4.2482, 0], [0, 0, 5.6881]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 18:00:24        2.241671        16.832450
BFGS:    1 18:00:24       -0.376431         9.027939
BFGS:    2 18:00:24       -1.748319         4.278075
BFGS:    3 18:00:24       -2.291866         1.513330
BFGS:    4 18:00:24       -2.392002         0.392847
BFGS:    5 18:00:24       -2.400310         0.050822
BFGS:    6 18:00:24       -2.400458         0.002034
BFGS:    7 18:00:24       -2.400459         0.000011
BFGS:    8 18:00:24       -2.400459         0.000000
Minimization converged after 8 steps.
Maximum force component: 1.7019490228137054e-09 eV/Angstrom
Maximum stress component: 3.392292400456203e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['N', 'N', 'N', 'N']
basis =  [[1.22548893e-01 1.22548893e-01 0.00000000e+00]
 [8.77451107e-01 8.77451107e-01 7.12879766e-34]
 [3.77451107e-01 6.22548893e-01 5.00000000e-01]
 [6.22548893e-01 3.77451107e-01 5.00000000e-01]]
cellpar =  Cell([[4.323698755819072, 9.080054733857125e-35, 3.445226785625486e-46], [5.678976741302507e-35, 4.323698755819072, 7.358731975495727e-27], [-1.2558824647871467e-38, 9.680879086247786e-27, 5.688099999999994]])
forces =  [[ 1.70194902e-09  1.70194902e-09  2.89663721e-36]
 [-1.70194902e-09 -1.70194902e-09 -2.89663721e-36]
 [-1.70194902e-09  1.70194902e-09  2.89663721e-36]
 [ 1.70194902e-09 -1.70194902e-09 -2.89663721e-36]]
stress =  [-3.39229240e-11 -3.39229240e-11 -1.20196322e-51  2.01925994e-31
 -7.48984089e-50 -1.50627240e-63]
energy per atom =  -0.6001146638018777
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0