Enter a model name: === Verification check vc-memory-leak start (2022-11-29 19:10:35) === !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! !!!!! !!!!! !!!!! VERIFICATION CHECK: vc-memory-leak !!!!! !!!!! !!!!! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! Description: Check that the model has no memory leaks. This is tested using the Valgrind memory debugging tool (http://valgrind.org) by performing a series of energy and force calculations on a randomly distorted face-centered cubic (FCC) cube base structure for both non-periodic and periodic boundary conditions. Separate configurations are tested for each species supported by the model, as well as one containing a random distribution of all species. Configurations used for testing are provided as auxiliary files. Author: Ellad Tadmor and Daniel S. Karls ----------------------------------------------------------------------------------------------------- Results for KIM Model : EAM_Dynamo_NicholAckland_2016v2_Cs__MO_144828415103_000 Supported species : Cs random seed = 13 lattice constant (orig) = 3.000 perturbation amplitude = 0.300 number unit cells per side = 2 ----------------------------------------------------------------------------------------------------- MONOATOMIC STRUCTURE (pbc=False)-- Species = Cs (Configuration in file "config-F-Cs.xyz") ----------------------------------------------------------------------------------------------------- Energy = 668.6439863231875 Forces: 1 -1.32632297e+01 -5.88951245e+01 -4.46715214e+01 2 -1.54183073e+01 1.89989288e+01 -2.91813422e+01 3 1.59525815e+00 -3.65288924e+01 -9.66950967e+00 4 -2.65824595e+01 4.06070576e+01 3.51468028e+01 5 1.29066384e+01 -4.51265176e+01 -1.59905119e+01 6 2.06749711e+01 3.85052013e+00 -2.64920366e+01 7 2.31737437e+01 -1.03979221e+02 -9.29541096e+01 8 -9.07215123e+01 -7.88209319e+01 -3.42610788e+00 9 -2.20948337e+01 -3.79922196e+01 -7.12443951e+01 10 -1.10647666e+01 5.54325295e+01 -6.48661551e+01 11 -2.09687015e+01 -3.50833347e+01 1.33107912e+01 12 -4.31469023e+01 5.62642079e+01 3.82974025e+01 13 -1.89732933e+01 -2.53768504e+01 -1.23755167e+02 14 2.45882278e+01 2.46586414e+01 -1.42974461e+01 15 1.51520564e+02 4.66535550e+01 1.67528750e+01 16 3.05708564e+01 8.70198395e+01 4.31001753e+01 17 -6.44831480e+01 -4.89880789e+01 -4.45824461e+01 18 1.35741244e+01 3.02781397e+01 2.86535908e+00 19 3.45995858e+01 -3.95471243e+01 3.85601283e+01 20 -2.20268771e+01 4.07635571e+01 4.77159523e+01 21 -3.39556367e+01 -3.86000888e+01 2.03239088e+01 22 7.33168739e+01 7.07524796e+01 8.45924619e+01 23 2.22085400e+01 -1.23661024e+01 2.28873567e+01 24 7.57113568e-01 1.53447601e+01 2.40473091e+01 25 -4.46728813e+01 -9.45814796e+00 -1.37812029e+00 26 -2.05110587e+01 6.24365256e+01 -2.46817489e+01 27 5.23884225e+01 -1.08517556e+02 4.21914993e+01 28 -9.91016315e+01 8.80713624e+01 2.06475165e+01 29 -1.92198554e+01 -1.95349528e+01 2.81638292e+01 30 2.70121993e+01 3.42033031e+01 -2.10519889e+00 31 4.94158304e+01 -2.26782664e+01 4.06695429e+01 32 2.79021458e+01 4.61580028e+01 5.00229057e+01 MONOATOMIC STRUCTURE (pbc=True)-- Species = Cs (Configuration in file "config-T-Cs.xyz") ----------------------------------------------------------------------------------------------------- Energy = 668.6439863231875 Forces: 1 -1.32632297e+01 -5.88951245e+01 -4.46715214e+01 2 -1.54183073e+01 1.89989288e+01 -2.91813422e+01 3 1.59525815e+00 -3.65288924e+01 -9.66950967e+00 4 -2.65824595e+01 4.06070576e+01 3.51468028e+01 5 1.29066384e+01 -4.51265176e+01 -1.59905119e+01 6 2.06749711e+01 3.85052013e+00 -2.64920366e+01 7 2.31737437e+01 -1.03979221e+02 -9.29541096e+01 8 -9.07215123e+01 -7.88209319e+01 -3.42610788e+00 9 -2.20948337e+01 -3.79922196e+01 -7.12443951e+01 10 -1.10647666e+01 5.54325295e+01 -6.48661551e+01 11 -2.09687015e+01 -3.50833347e+01 1.33107912e+01 12 -4.31469023e+01 5.62642079e+01 3.82974025e+01 13 -1.89732933e+01 -2.53768504e+01 -1.23755167e+02 14 2.45882278e+01 2.46586414e+01 -1.42974461e+01 15 1.51520564e+02 4.66535550e+01 1.67528750e+01 16 3.05708564e+01 8.70198395e+01 4.31001753e+01 17 -6.44831480e+01 -4.89880789e+01 -4.45824461e+01 18 1.35741244e+01 3.02781397e+01 2.86535908e+00 19 3.45995858e+01 -3.95471243e+01 3.85601283e+01 20 -2.20268771e+01 4.07635571e+01 4.77159523e+01 21 -3.39556367e+01 -3.86000888e+01 2.03239088e+01 22 7.33168739e+01 7.07524796e+01 8.45924619e+01 23 2.22085400e+01 -1.23661024e+01 2.28873567e+01 24 7.57113568e-01 1.53447601e+01 2.40473091e+01 25 -4.46728813e+01 -9.45814796e+00 -1.37812029e+00 26 -2.05110587e+01 6.24365256e+01 -2.46817489e+01 27 5.23884225e+01 -1.08517556e+02 4.21914993e+01 28 -9.91016315e+01 8.80713624e+01 2.06475165e+01 29 -1.92198554e+01 -1.95349528e+01 2.81638292e+01 30 2.70121993e+01 3.42033031e+01 -2.10519889e+00 31 4.94158304e+01 -2.26782664e+01 4.06695429e+01 32 2.79021458e+01 4.61580028e+01 5.00229057e+01 ERROR: Unable to perform verification check. Message = Failed to run valgrind; check that it is installed. === Verification check vc-memory-leak end (2022-11-29 19:11:50) ===