Enter a model name: === Verification check vc-memory-leak start (2022-11-29 18:35:13) === !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! !!!!! !!!!! !!!!! 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_FoilesBaskesDaw_1986Universal3_Au__MO_559016907324_000 Supported species : Au random seed = 13 lattice constant (orig) = 3.000 perturbation amplitude = 0.300 number unit cells per side = 2 ----------------------------------------------------------------------------------------------------- MONOATOMIC STRUCTURE (pbc=False)-- Species = Au (Configuration in file "config-F-Au.xyz") ----------------------------------------------------------------------------------------------------- Energy = 219.18640198409003 Forces: 1 -1.65081236e+01 -3.30143151e+01 -3.71221132e+01 2 -1.11993716e+01 1.86221597e+01 -2.94288583e+01 3 1.43143531e+01 -2.85199298e+01 -3.22469769e-01 4 -2.46423445e+01 2.96617334e+01 1.85709440e+01 5 1.98992046e+01 -3.85390551e+01 -7.79622993e+00 6 1.29936708e+01 -6.08066330e+00 -1.79268647e+01 7 1.88779448e+01 -5.95940137e+01 -5.36833845e+01 8 -3.74467586e+01 -3.53041001e+01 -3.58712935e+00 9 -2.60381749e+01 -1.07151123e+01 -3.98542886e+01 10 -9.41035738e+00 4.55490188e+01 -4.47678435e+01 11 -2.28313749e+01 -2.77799275e+01 2.29474124e+01 12 -2.57242365e+01 2.45158159e+01 1.44411807e+01 13 -4.35592941e+00 -1.37417423e+01 -8.67285963e+01 14 1.67468591e+01 1.76752742e+01 -1.22737621e+01 15 8.60778601e+01 9.52764513e+00 1.30625030e+01 16 1.37413743e+01 6.62116837e+01 2.36245434e+01 17 -4.05623881e+01 -2.13933143e+01 1.50443948e-01 18 1.55540947e+01 1.77475217e+01 -5.90011442e+00 19 1.13709914e+01 -2.44442201e+01 2.48284892e+01 20 -1.74399215e+01 3.90538662e+00 2.02628191e+01 21 -2.05519596e+01 -2.56415067e+01 1.82407679e+01 22 4.83741375e+01 3.28928539e+01 4.56974454e+01 23 7.26749517e+00 -4.76791829e+00 1.09247301e+01 24 5.01768856e+00 -1.27208791e+00 1.58121518e+01 25 -3.88894337e+01 -1.39371718e+01 -3.07353476e+01 26 -1.10038479e+01 4.76825356e+01 -1.76145020e+01 27 2.90296203e+01 -5.24423517e+01 4.53034629e+01 28 -5.47792003e+01 5.41448270e+01 2.49628886e+01 29 -1.26206263e+01 -1.62241337e+01 2.24015526e+01 30 2.23307752e+01 2.71577463e+01 1.40906010e+00 31 3.30896222e+01 -1.36328908e+01 2.91574310e+01 32 1.93183569e+01 3.17502526e+01 3.59436783e+01 MONOATOMIC STRUCTURE (pbc=True)-- Species = Au (Configuration in file "config-T-Au.xyz") ----------------------------------------------------------------------------------------------------- Energy = 219.18640198409003 Forces: 1 -1.65081236e+01 -3.30143151e+01 -3.71221132e+01 2 -1.11993716e+01 1.86221597e+01 -2.94288583e+01 3 1.43143531e+01 -2.85199298e+01 -3.22469769e-01 4 -2.46423445e+01 2.96617334e+01 1.85709440e+01 5 1.98992046e+01 -3.85390551e+01 -7.79622993e+00 6 1.29936708e+01 -6.08066330e+00 -1.79268647e+01 7 1.88779448e+01 -5.95940137e+01 -5.36833845e+01 8 -3.74467586e+01 -3.53041001e+01 -3.58712935e+00 9 -2.60381749e+01 -1.07151123e+01 -3.98542886e+01 10 -9.41035738e+00 4.55490188e+01 -4.47678435e+01 11 -2.28313749e+01 -2.77799275e+01 2.29474124e+01 12 -2.57242365e+01 2.45158159e+01 1.44411807e+01 13 -4.35592941e+00 -1.37417423e+01 -8.67285963e+01 14 1.67468591e+01 1.76752742e+01 -1.22737621e+01 15 8.60778601e+01 9.52764513e+00 1.30625030e+01 16 1.37413743e+01 6.62116837e+01 2.36245434e+01 17 -4.05623881e+01 -2.13933143e+01 1.50443948e-01 18 1.55540947e+01 1.77475217e+01 -5.90011442e+00 19 1.13709914e+01 -2.44442201e+01 2.48284892e+01 20 -1.74399215e+01 3.90538662e+00 2.02628191e+01 21 -2.05519596e+01 -2.56415067e+01 1.82407679e+01 22 4.83741375e+01 3.28928539e+01 4.56974454e+01 23 7.26749517e+00 -4.76791829e+00 1.09247301e+01 24 5.01768856e+00 -1.27208791e+00 1.58121518e+01 25 -3.88894337e+01 -1.39371718e+01 -3.07353476e+01 26 -1.10038479e+01 4.76825356e+01 -1.76145020e+01 27 2.90296203e+01 -5.24423517e+01 4.53034629e+01 28 -5.47792003e+01 5.41448270e+01 2.49628886e+01 29 -1.26206263e+01 -1.62241337e+01 2.24015526e+01 30 2.23307752e+01 2.71577463e+01 1.40906010e+00 31 3.30896222e+01 -1.36328908e+01 2.91574310e+01 32 1.93183569e+01 3.17502526e+01 3.59436783e+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 18:35:36) ===