element(s):
['Rb']
AFLOW prototype label:
A_aP1_2_a
Parameter names:
['a', 'b/a', 'c/a', 'alpha', 'beta', 'gamma']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.9755', '1.0048236', '1.004904', '119.5488', '119.4172', '90.2172']
model name:
EAM_Dynamo_NicholAckland_2016v2_Rb__MO_874930365376_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Rb']
representative atom coordinates =  [[0 0 0]]
spacegroup =  2
cell =  [[4.9755, 0, 0], [-0.018952334856333, 4.999464077179, 0], [-2.4557772181876, -2.4751013479451, 3.5835780418503]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 16:35:31       -0.827561        0.0165
BFGS:    1 16:35:31       -0.827567        0.0162
BFGS:    2 16:35:31       -0.827709        0.0163
BFGS:    3 16:35:31       -0.827715        0.0172
BFGS:    4 16:35:31       -0.828294        0.0707
BFGS:    5 16:35:31       -0.830495        0.1045
BFGS:    6 16:35:31       -0.831388        0.0891
BFGS:    7 16:35:31       -0.834140        0.0732
BFGS:    8 16:35:31       -0.835138        0.0602
BFGS:    9 16:35:31       -0.835314        0.0616
BFGS:   10 16:35:31       -0.836841        0.0755
BFGS:   11 16:35:31       -0.837734        0.0632
BFGS:   12 16:35:31       -0.839038        0.0410
BFGS:   13 16:35:31       -0.839166        0.0393
BFGS:   14 16:35:31       -0.839393        0.0401
BFGS:   15 16:35:31       -0.839556        0.0344
BFGS:   16 16:35:31       -0.839720        0.0198
BFGS:   17 16:35:31       -0.839778        0.0102
BFGS:   18 16:35:31       -0.839795        0.0069
BFGS:   19 16:35:31       -0.839829        0.0034
BFGS:   20 16:35:31       -0.839830        0.0091
BFGS:   21 16:35:31       -0.839845        0.0029
BFGS:   22 16:35:31       -0.839846        0.0022
BFGS:   23 16:35:31       -0.839846        0.0017
BFGS:   24 16:35:31       -0.839846        0.0015
BFGS:   25 16:35:31       -0.839847        0.0011
BFGS:   26 16:35:31       -0.839847        0.0005
BFGS:   27 16:35:31       -0.839847        0.0001
BFGS:   28 16:35:31       -0.839847        0.0000
BFGS:   29 16:35:31       -0.839847        0.0000
BFGS:   30 16:35:31       -0.839847        0.0000
BFGS:   31 16:35:31       -0.839847        0.0000
BFGS:   32 16:35:31       -0.839847        0.0000
BFGS:   33 16:35:31       -0.839847        0.0000
BFGS:   34 16:35:31       -0.839847        0.0000
BFGS:   35 16:35:31       -0.839847        0.0000
BFGS:   36 16:35:31       -0.839847        0.0000
BFGS:   37 16:35:31       -0.839847        0.0000
BFGS:   38 16:35:31       -0.839847        0.0000
Minimization converged after 38 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 7.836071266197697e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Rb']
basis =  [[0. 0. 0.]]
cellpar =  Cell([[4.83797634300848, -0.5230210880764731, -0.00793122258249763], [-0.5455723840810252, 4.83548178132649, -0.009787354928921684], [-2.139057668799558, -2.1477370950019066, 3.8067422726019107]])
forces =  [[0. 0. 0.]]
stress =  [-7.83607127e-12  3.10980749e-12 -2.65317585e-12 -1.92080852e-12
 -5.80634077e-13 -3.76771430e-14]
energy per atom =  -0.8398473065060893
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Prototype label changed during relaxation: test template prototype is A_aP1_2_a, while relaxed is A_tI2_139_a. Skipping parameter set 0.
No parameter sets in this group successfully added a property instance. Skipping this group.