INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_cP72_205_2d_d --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_cP72_205_2d_d --params=11.056,0.092523766,0.91221875,0.99547365,0.18592766,0.82371183,0.99079663,0.26210555,0.7509167,0.98631112 --webpage INFO:kim_tools.test_driver.core:The configuration you provided has a maximum force component 15.32341113498524 eV/angstrom. Unless the Test Driver you are running provides minimization, you may wish to relax the configuration. INFO:kim_tools.test_driver.core:The configuration you provided has a maximum stress component 0.09464982534295996 eV/angstrom^3 even though the nominal state of the system is unstressed. Unless the Test Driver you are running provides minimization, you may wish to relax the configuration. INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_cP72_205_2d_d --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_cP72_205_2d_d --params=11.056,0.092523766,0.91221875,0.99547365,0.18592766,0.82371183,0.99079663,0.26210555,0.7509167,0.98631112 --webpage INFO:kim_tools.test_driver.core:Minimization stopped after hitting the maximum of 200 steps. INFO:kim_tools.test_driver.core:Final forces: INFO:kim_tools.test_driver.core:[[ 4.56915796e-04 -1.07604201e-04 2.35233419e-04] [-4.56915734e-04 1.07604302e-04 2.35233644e-04] [-4.56915862e-04 -1.07604135e-04 -2.35233353e-04] [ 4.56915860e-04 1.07604176e-04 -2.35233352e-04] [ 2.35233420e-04 4.56915794e-04 -1.07604201e-04] [ 2.35233344e-04 -4.56915877e-04 1.07604164e-04] [-2.35233355e-04 -4.56915861e-04 -1.07604136e-04] [-2.35233352e-04 4.56915859e-04 1.07604176e-04] [-1.07604202e-04 2.35233420e-04 4.56915793e-04] [ 1.07604163e-04 2.35233343e-04 -4.56915879e-04] [-1.07604170e-04 -2.35233428e-04 -4.56915824e-04] [ 1.07604244e-04 -2.35233502e-04 4.56915788e-04] [-4.56915847e-04 1.07604168e-04 -2.35233406e-04] [ 4.56915772e-04 -1.07604226e-04 -2.35233513e-04] [ 4.56915809e-04 1.07604229e-04 2.35233443e-04] [-4.56915822e-04 -1.07604188e-04 2.35233406e-04] [-2.35233331e-04 -4.56915883e-04 1.07604134e-04] [-2.35233366e-04 4.56915841e-04 -1.07604159e-04] [ 2.35233519e-04 4.56915773e-04 1.07604266e-04] [ 2.35233330e-04 -4.56915859e-04 -1.07604152e-04] [ 1.07604203e-04 -2.35233481e-04 -4.56915811e-04] [-1.07604225e-04 -2.35233513e-04 4.56915772e-04] [ 1.07604231e-04 2.35233444e-04 4.56915808e-04] [-1.07604223e-04 2.35233481e-04 -4.56915787e-04] [-8.73751286e-05 -4.02040340e-04 -5.12787076e-04] [ 8.73748634e-05 4.02040203e-04 -5.12787626e-04] [ 8.73753415e-05 -4.02040453e-04 5.12786900e-04] [-8.73752549e-05 4.02040448e-04 5.12786892e-04] [-5.12787077e-04 -8.73751262e-05 -4.02040337e-04] [-5.12786927e-04 8.73751993e-05 4.02040520e-04] [ 5.12786903e-04 8.73753357e-05 -4.02040456e-04] [ 5.12786893e-04 -8.73752562e-05 4.02040443e-04] [-4.02040335e-04 -5.12787077e-04 -8.73751251e-05] [ 4.02040521e-04 -5.12786926e-04 8.73752052e-05] [-4.02040370e-04 5.12787076e-04 8.73752542e-05] [ 4.02040286e-04 5.12787242e-04 -8.73750900e-05] [ 8.73752403e-05 4.02040434e-04 5.12787035e-04] [-8.73751187e-05 -4.02040254e-04 5.12787274e-04] [-8.73750781e-05 4.02040360e-04 -5.12787131e-04] [ 8.73751603e-05 -4.02040390e-04 -5.12787056e-04] [ 5.12786861e-04 8.73753182e-05 4.02040514e-04] [ 5.12786927e-04 -8.73752838e-05 -4.02040409e-04] [-5.12787306e-04 -8.73749842e-05 4.02040284e-04] [-5.12786880e-04 8.73752485e-05 -4.02040470e-04] [ 4.02040357e-04 5.12787210e-04 8.73751519e-05] [-4.02040257e-04 5.12787271e-04 -8.73751199e-05] [ 4.02040356e-04 -5.12787134e-04 -8.73750704e-05] [-4.02040305e-04 -5.12787230e-04 8.73750789e-05] [-1.28877384e-04 3.83148131e-04 3.21018493e-04] [ 1.28877566e-04 -3.83148084e-04 3.21018806e-04] [ 1.28877237e-04 3.83148169e-04 -3.21018393e-04] [-1.28877307e-04 -3.83148187e-04 -3.21018388e-04] [ 3.21018493e-04 -1.28877385e-04 3.83148128e-04] [ 3.21018407e-04 1.28877374e-04 -3.83148265e-04] [-3.21018394e-04 1.28877242e-04 3.83148172e-04] [-3.21018388e-04 -1.28877305e-04 -3.83148183e-04] [ 3.83148126e-04 3.21018493e-04 -1.28877384e-04] [-3.83148264e-04 3.21018407e-04 1.28877370e-04] [ 3.83148122e-04 -3.21018493e-04 1.28877287e-04] [-3.83148094e-04 -3.21018587e-04 -1.28877400e-04] [ 1.28877325e-04 -3.83148189e-04 -3.21018469e-04] [-1.28877362e-04 3.83148053e-04 -3.21018606e-04] [-1.28877426e-04 -3.83148155e-04 3.21018524e-04] [ 1.28877372e-04 3.83148166e-04 3.21018481e-04] [-3.21018370e-04 1.28877282e-04 -3.83148236e-04] [-3.21018408e-04 -1.28877268e-04 3.83148142e-04] [ 3.21018623e-04 -1.28877483e-04 -3.83148116e-04] [ 3.21018381e-04 1.28877321e-04 3.83148210e-04] [-3.83148147e-04 -3.21018569e-04 1.28877377e-04] [ 3.83148056e-04 -3.21018604e-04 -1.28877363e-04] [-3.83148154e-04 3.21018525e-04 -1.28877431e-04] [ 3.83148115e-04 3.21018581e-04 1.28877417e-04]] INFO:kim_tools.test_driver.core:Final stress: INFO:kim_tools.test_driver.core:[ 1.30659662e-06 1.30659662e-06 1.30659662e-06 -5.17335834e-14 -5.92890713e-14 -4.92479425e-14] INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:Attempting to find NN distance by searching within covalent radii times 1 INFO:kim_tools.aflow_util.core:Automatically set max fractional residual for solving position equations to 0.0010508570235423672 INFO:kim_tools.aflow_util.core:aflow --np=4 --prim < /tmp/tmpcqkd5u2z | aflow --np=4 --compare2prototypes --catalog=anrl --quiet --print=json INFO:kim_tools.aflow_util.core:Detected encyclopedia entry None: None INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_cP72_205_2d_d --params=10.516,0.096072672,0.90225375,0.0016660831,0.80604673,0.30256695,0.49677886,0.76759454,0.72760895,0.49565385 --webpage INFO:kim_tools.aflow_util.core:Initial shift (to SOME standard origin, not necessarily the desired one): [-5.25801e+00 -5.25801e+00 -6.36842e-06] (Cartesian), [-5.00001671e-01 -5.00001671e-01 -6.05594253e-07] (fractional) INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_cP72_205_2d_d --equations_only INFO:kim_tools.aflow_util.core:Additionally shifting atoms by internal fractional translation [0.0, 0.0, 0.0] INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_cP72_205_2d_d --params=10.515984860718136,0.9983322461080701,0.0960710010409449,0.9022531399133229,0.5032194691579379,0.8060450604689211,0.3025663421754279,0.5043444795018828,0.767592873022432,0.7276083418886004 --webpage INFO:kim_tools.symmetry_util.core:Attempting to match fractional rotation: [[ 1. 0. 0.] [ 0. -1. 0.] [ 0. 0. -1.]] INFO:kim_tools.symmetry_util.core:Found matching rotation with point group op: [[1.0, 0.0, 0.0], [0.0, -1.0, 0.0], [0.0, 0.0, -1.0]] INFO:kim_tools.aflow_util.core:Found set of parameters for prototype A2B_cP72_205_2d_d that is unrotated INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_cP72_205_2d_d --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_cP72_205_2d_d --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_cP72_205_2d_d --params=10.515984860718136,0.9983322461080701,0.0960710010409449,0.9022531399133229,0.5032194691579379,0.8060450604689211,0.3025663421754279,0.5043444795018828,0.767592873022432,0.7276083418886004 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_cP72_205_2d_d --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_cP72_205_2d_d --params=10.515984860718136,0.9983322461080701,0.0960710010409449,0.9022531399133229,0.5032194691579379,0.8060450604689211,0.3025663421754279,0.5043444795018828,0.767592873022432,0.7276083418886004 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_cP72_205_2d_d --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_cP72_205_2d_d --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_cP72_205_2d_d --params=10.515984860718136,0.9983322461080701,0.0960710010409449,0.9022531399133229,0.5032194691579379,0.8060450604689211,0.3025663421754279,0.5043444795018828,0.767592873022432,0.7276083418886004 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_cP72_205_2d_d --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_cP72_205_2d_d --params=10.515984860718136,0.9983322461080701,0.0960710010409449,0.9022531399133229,0.5032194691579379,0.8060450604689211,0.3025663421754279,0.5043444795018828,0.767592873022432,0.7276083418886004 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_cP72_205_2d_d --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_cP72_205_2d_d --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_cP72_205_2d_d --params=10.515984860718136,0.9983322461080701,0.0960710010409449,0.9022531399133229,0.5032194691579379,0.8060450604689211,0.3025663421754279,0.5043444795018828,0.767592873022432,0.7276083418886004 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_cP72_205_2d_d --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_cP72_205_2d_d --params=10.515984860718136,0.9983322461080701,0.0960710010409449,0.9022531399133229,0.5032194691579379,0.8060450604689211,0.3025663421754279,0.5043444795018828,0.767592873022432,0.7276083418886004 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_cP72_205_2d_d --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_cP72_205_2d_d --params=10.515984860718136,0.9983322461080701,0.0960710010409449,0.9022531399133229,0.5032194691579379,0.8060450604689211,0.3025663421754279,0.5043444795018828,0.767592873022432,0.7276083418886004 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_cP72_205_2d_d --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_cP72_205_2d_d --params=10.515984860718136,0.9983322461080701,0.0960710010409449,0.9022531399133229,0.5032194691579379,0.8060450604689211,0.3025663421754279,0.5043444795018828,0.767592873022432,0.7276083418886004 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmplwr08axv --no_scale_volume --screen_only --quiet --print=json INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_cP72_205_2d_d --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_cP72_205_2d_d --params=10.515984860718136,0.9983322461080701,0.0960710010409449,0.9022531399133229,0.5032194691579379,0.8060450604689211,0.3025663421754279,0.5043444795018828,0.767592873022432,0.7276083418886004 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmpg7iml2ym --no_scale_volume --screen_only --quiet --print=json INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --version INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_cP72_205_2d_d --parameter_symbols_only INFO:kim_tools.aflow_util.core:aflow --np=4 --proto=A2B_cP72_205_2d_d --params=10.515984860718136,0.9983322461080701,0.0960710010409449,0.9022531399133229,0.5032194691579379,0.8060450604689211,0.3025663421754279,0.5043444795018828,0.767592873022432,0.7276083418886004 --webpage INFO:kim_tools.aflow_util.core:aflow --np=4 --compare_materials -D /tmp/tmp1jbyjpoz --no_scale_volume --screen_only --quiet --print=json INFO:kim_tools.test_driver.core:Deduplicated 3 Property Instances down to 3.