Enter a model name: === Verification check vc-memory-leak start (2022-11-29 18:44:46) === !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! !!!!! !!!!! !!!!! 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 : MEAM_LAMMPS_EtesamiAsadi_2018_Ni__MO_937008984446_001 Supported species : Ni random seed = 13 lattice constant (orig) = 3.000 perturbation amplitude = 0.300 number unit cells per side = 2 ----------------------------------------------------------------------------------------------------- MONOATOMIC STRUCTURE (pbc=False)-- Species = Ni (Configuration in file "config-F-Ni.xyz") ----------------------------------------------------------------------------------------------------- Energy = -11.200356067194507 Forces: 1 -1.32537506e+01 -1.90144660e+01 -3.67548963e+01 2 -7.30715012e+00 9.34053012e+00 -3.43234505e+00 3 3.82136486e+01 -2.41199909e+01 1.76837061e+01 4 -2.66494988e+01 4.02665899e+01 1.66900857e+01 5 1.00645798e+00 -1.49644416e+01 1.54543908e+00 6 6.54075508e+00 7.35159391e+00 -2.22850029e+00 7 -2.33119167e+00 -5.66921849e+01 -5.81547725e+01 8 -9.57936195e+00 -1.20736005e+01 6.09465447e-01 9 -4.55443391e+00 -3.22154865e+00 -2.81680966e+00 10 -1.10064245e+01 1.32405726e+01 -1.55605208e+01 11 -8.47299667e+00 -1.30915231e+01 5.12759027e+00 12 -6.27550779e+00 2.31127737e+01 -1.65345049e+01 13 -1.12070639e+01 -1.17092826e+01 -4.36977310e+01 14 5.21351716e+00 7.88120384e+00 -5.50543858e+00 15 3.15519499e+01 -1.57244955e+01 1.55108369e+01 16 8.47818398e+00 2.11938405e+01 1.88999121e+01 17 -8.63252142e+00 -9.68908312e+00 -6.89870427e+00 18 3.05388479e+00 1.11299910e+01 -1.11031121e+01 19 -3.56614194e+00 -1.57809864e+01 8.57894396e+00 20 -3.65973302e+00 7.41596602e+00 8.90812913e+00 21 -7.30950415e+00 -7.44268304e+00 -3.62613257e+00 22 1.60585910e+01 5.67981441e+01 5.55274443e+01 23 3.84372832e+00 -3.31660999e-01 5.85836013e+00 24 1.17082631e+01 7.02036409e+00 7.17760121e+00 25 9.23336585e-01 -1.69276869e+01 2.20732679e+01 26 -7.42992533e+00 8.99466410e+00 -8.78461122e+00 27 3.43266650e+01 -4.85126857e+01 6.26127696e+00 28 -4.53324017e+01 3.97683456e+01 1.08012929e+00 29 -1.09286434e+01 -8.25779523e+00 -1.19862426e+01 30 3.82164869e+00 1.23941780e+01 1.16713634e+01 31 1.78035669e+01 -2.50568259e+00 9.48181551e+00 32 4.95205366e+00 1.41510401e+01 1.43989544e+01 MONOATOMIC STRUCTURE (pbc=True)-- Species = Ni (Configuration in file "config-T-Ni.xyz") ----------------------------------------------------------------------------------------------------- Energy = -11.200356067194507 Forces: 1 -1.32537506e+01 -1.90144660e+01 -3.67548963e+01 2 -7.30715012e+00 9.34053012e+00 -3.43234505e+00 3 3.82136486e+01 -2.41199909e+01 1.76837061e+01 4 -2.66494988e+01 4.02665899e+01 1.66900857e+01 5 1.00645798e+00 -1.49644416e+01 1.54543908e+00 6 6.54075508e+00 7.35159391e+00 -2.22850029e+00 7 -2.33119167e+00 -5.66921849e+01 -5.81547725e+01 8 -9.57936195e+00 -1.20736005e+01 6.09465447e-01 9 -4.55443391e+00 -3.22154865e+00 -2.81680966e+00 10 -1.10064245e+01 1.32405726e+01 -1.55605208e+01 11 -8.47299667e+00 -1.30915231e+01 5.12759027e+00 12 -6.27550779e+00 2.31127737e+01 -1.65345049e+01 13 -1.12070639e+01 -1.17092826e+01 -4.36977310e+01 14 5.21351716e+00 7.88120384e+00 -5.50543858e+00 15 3.15519499e+01 -1.57244955e+01 1.55108369e+01 16 8.47818398e+00 2.11938405e+01 1.88999121e+01 17 -8.63252142e+00 -9.68908312e+00 -6.89870427e+00 18 3.05388479e+00 1.11299910e+01 -1.11031121e+01 19 -3.56614194e+00 -1.57809864e+01 8.57894396e+00 20 -3.65973302e+00 7.41596602e+00 8.90812913e+00 21 -7.30950415e+00 -7.44268304e+00 -3.62613257e+00 22 1.60585910e+01 5.67981441e+01 5.55274443e+01 23 3.84372832e+00 -3.31660999e-01 5.85836013e+00 24 1.17082631e+01 7.02036409e+00 7.17760121e+00 25 9.23336585e-01 -1.69276869e+01 2.20732679e+01 26 -7.42992533e+00 8.99466410e+00 -8.78461122e+00 27 3.43266650e+01 -4.85126857e+01 6.26127696e+00 28 -4.53324017e+01 3.97683456e+01 1.08012929e+00 29 -1.09286434e+01 -8.25779523e+00 -1.19862426e+01 30 3.82164869e+00 1.23941780e+01 1.16713634e+01 31 1.78035669e+01 -2.50568259e+00 9.48181551e+00 32 4.95205366e+00 1.41510401e+01 1.43989544e+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 18:45:04) ===