element(s):
['P']
AFLOW prototype label:
A_tI4_139_e
Parameter names:
['a', 'c/a', 'z1']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['2.4848', '4.3092402', '0.10450128']
model name:
EAM_Dynamo_AcklandMendelevSrolovitz_2004_FeP__MO_884343146310_005
==== Building ASE atoms object with: ====
representative atom symbols =  ['P']
representative atom coordinates =  [[0.         0.         0.10450128]]
spacegroup =  139
cell =  [[2.4848, 0, 0], [0, 2.4848, 0], [0, 0, 10.7076]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 09:47:50        5.721156        10.120391
BFGS:    1 09:47:50        3.647536         9.026560
BFGS:    2 09:47:50        2.062325         8.096346
BFGS:    3 09:47:50        0.786316         7.271792
BFGS:    4 09:47:50       -0.276346         6.528418
BFGS:    5 09:47:50       -1.184077         5.852412
BFGS:    6 09:47:50       -1.971684         5.235632
BFGS:    7 09:47:50       -2.659699         4.671780
BFGS:    8 09:47:50       -3.262642         4.155206
BFGS:    9 09:47:50       -3.791419         3.681114
BFGS:   10 09:47:50       -4.254585         3.245293
BFGS:   11 09:47:50       -4.659061         2.843936
BFGS:   12 09:47:50       -5.010565         2.473422
BFGS:   13 09:47:50       -5.313890         2.130190
BFGS:   14 09:47:50       -5.573081         1.810894
BFGS:   15 09:47:50       -5.791564         1.512419
BFGS:   16 09:47:50       -5.972274         1.232939
BFGS:   17 09:47:50       -6.118443         0.978050
BFGS:   18 09:47:50       -6.233813         0.748452
BFGS:   19 09:47:50       -6.321961         0.543588
BFGS:   20 09:47:50       -6.386273         0.362694
BFGS:   21 09:47:50       -6.429902         0.273920
BFGS:   22 09:47:50       -6.455833         0.320730
BFGS:   23 09:47:50       -6.466927         0.335630
BFGS:   24 09:47:50       -6.469427         0.316251
BFGS:   25 09:47:50       -6.473801         0.243827
BFGS:   26 09:47:50       -6.477312         0.148263
BFGS:   27 09:47:50       -6.479644         0.104874
BFGS:   28 09:47:50       -6.480756         0.089133
BFGS:   29 09:47:50       -6.481650         0.069984
BFGS:   30 09:47:50       -6.482812         0.052642
BFGS:   31 09:47:50       -6.483593         0.021192
BFGS:   32 09:47:50       -6.483805         0.005826
BFGS:   33 09:47:50       -6.483821         0.001230
BFGS:   34 09:47:50       -6.483822         0.000092
BFGS:   35 09:47:50       -6.483822         0.000006
BFGS:   36 09:47:50       -6.483822         0.000000
BFGS:   37 09:47:50       -6.483822         0.000000
BFGS:   38 09:47:50       -6.483822         0.000000
Minimization converged after 38 steps.
Maximum force component: 3.391750152837344e-10 eV/Angstrom
Maximum stress component: 7.582345325870301e-11 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['P', 'P', 'P', 'P']
basis =  [[0.00000000e+00 0.00000000e+00 1.41442267e-01]
 [1.65810531e-33 1.60045605e-16 8.58557733e-01]
 [5.00000000e-01 5.00000000e-01 6.41442267e-01]
 [5.00000000e-01 5.00000000e-01 3.58557733e-01]]
cellpar =  Cell([[3.2142627338968444, 3.401778184104286e-35, -9.626328729941147e-32], [5.761534504565999e-35, 3.2142627338968435, -1.4204143660736245e-17], [1.1462180955270792e-33, -7.34477245709451e-16, 11.233003997270384]])
forces =  [[-6.19044485e-34  2.21771800e-26 -3.39175015e-10]
 [-2.47617794e-33 -2.21771804e-26  3.39175015e-10]
 [-3.46094900e-44  2.21771794e-26 -3.39175015e-10]
 [-1.23808897e-33 -2.21771794e-26  3.39175015e-10]]
stress =  [-1.99379374e-11 -1.99379374e-11  7.58234533e-11 -3.65703294e-26
 -1.70692004e-34  8.51780562e-50]
energy per atom =  -1.6209554048201722
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0