Enter a model name: === Verification check vc-memory-leak start (2022-11-29 20:36:30) === !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! !!!!! !!!!! !!!!! 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_AsadiZaeemNouranian_2015_Cu__MO_390178379548_001 Supported species : Cu random seed = 13 lattice constant (orig) = 3.000 perturbation amplitude = 0.300 number unit cells per side = 2 ----------------------------------------------------------------------------------------------------- MONOATOMIC STRUCTURE (pbc=False)-- Species = Cu (Configuration in file "config-F-Cu.xyz") ----------------------------------------------------------------------------------------------------- Energy = -10.674951828457402 Forces: 1 -1.50142041e-01 -5.84841456e+00 -6.27925616e+00 2 -7.22762070e+00 8.77832341e+00 -2.24391823e+00 3 4.33253899e+00 -1.07453523e+01 -7.16011997e+00 4 -5.72180980e+00 4.87595981e+00 3.86528419e+00 5 6.50626774e+00 -1.20443369e+01 -5.52211191e-01 6 2.64262468e+00 2.96544248e+00 -2.24526484e+00 7 7.81693923e-01 -2.15320060e+01 -2.23149789e+01 8 -1.06296090e+01 -8.47024141e+00 -4.91138455e+00 9 -9.63794998e+00 -5.18357417e+00 -1.23179905e+01 10 -5.70337926e+00 1.61326946e+01 -1.45621664e+01 11 3.94677193e+00 -1.04784743e+01 1.03361154e+01 12 -6.93416305e+00 1.06211425e+01 2.99014958e+00 13 -4.58699303e+00 -9.38113256e+00 -2.67890009e+01 14 3.96182331e+00 6.14033675e+00 -4.54506247e+00 15 2.63391650e+01 -4.92837528e+00 1.18267611e+01 16 5.02372851e+00 1.53290538e+01 9.29157989e+00 17 -9.48986784e+00 -4.85584874e+00 -4.05341012e+00 18 2.46226348e+00 9.80370800e+00 4.96318631e+00 19 3.59937181e+00 -5.96474489e+00 5.43634837e+00 20 -3.13702659e+00 6.26303499e+00 4.43103936e+00 21 -1.32493815e+01 -9.51519433e+00 1.99208530e+00 22 1.90315642e+01 2.25082596e+01 1.87563031e+01 23 4.83594236e+00 -1.00901235e+00 6.12800306e+00 24 1.66241265e+00 5.85613281e-01 2.55055961e+00 25 -3.62259385e+00 -7.59202605e+00 -6.87508130e-01 26 -3.33763736e+00 8.60723932e+00 -8.85155497e+00 27 6.69456865e+00 -2.19910447e+01 2.70467840e+00 28 -2.02782671e+01 1.94086113e+01 1.24176561e+01 29 -6.31326982e+00 -5.08026163e+00 2.63622859e+00 30 5.42961516e+00 1.01584181e+01 -4.81299264e+00 31 6.92445707e+00 -9.76738469e+00 8.93646793e+00 32 5.84490153e+00 1.22095870e+01 1.30643738e+01 MONOATOMIC STRUCTURE (pbc=True)-- Species = Cu (Configuration in file "config-T-Cu.xyz") ----------------------------------------------------------------------------------------------------- Energy = -10.674951828457402 Forces: 1 -1.50142041e-01 -5.84841456e+00 -6.27925616e+00 2 -7.22762070e+00 8.77832341e+00 -2.24391823e+00 3 4.33253899e+00 -1.07453523e+01 -7.16011997e+00 4 -5.72180980e+00 4.87595981e+00 3.86528419e+00 5 6.50626774e+00 -1.20443369e+01 -5.52211191e-01 6 2.64262468e+00 2.96544248e+00 -2.24526484e+00 7 7.81693923e-01 -2.15320060e+01 -2.23149789e+01 8 -1.06296090e+01 -8.47024141e+00 -4.91138455e+00 9 -9.63794998e+00 -5.18357417e+00 -1.23179905e+01 10 -5.70337926e+00 1.61326946e+01 -1.45621664e+01 11 3.94677193e+00 -1.04784743e+01 1.03361154e+01 12 -6.93416305e+00 1.06211425e+01 2.99014958e+00 13 -4.58699303e+00 -9.38113256e+00 -2.67890009e+01 14 3.96182331e+00 6.14033675e+00 -4.54506247e+00 15 2.63391650e+01 -4.92837528e+00 1.18267611e+01 16 5.02372851e+00 1.53290538e+01 9.29157989e+00 17 -9.48986784e+00 -4.85584874e+00 -4.05341012e+00 18 2.46226348e+00 9.80370800e+00 4.96318631e+00 19 3.59937181e+00 -5.96474489e+00 5.43634837e+00 20 -3.13702659e+00 6.26303499e+00 4.43103936e+00 21 -1.32493815e+01 -9.51519433e+00 1.99208530e+00 22 1.90315642e+01 2.25082596e+01 1.87563031e+01 23 4.83594236e+00 -1.00901235e+00 6.12800306e+00 24 1.66241265e+00 5.85613281e-01 2.55055961e+00 25 -3.62259385e+00 -7.59202605e+00 -6.87508130e-01 26 -3.33763736e+00 8.60723932e+00 -8.85155497e+00 27 6.69456865e+00 -2.19910447e+01 2.70467840e+00 28 -2.02782671e+01 1.94086113e+01 1.24176561e+01 29 -6.31326982e+00 -5.08026163e+00 2.63622859e+00 30 5.42961516e+00 1.01584181e+01 -4.81299264e+00 31 6.92445707e+00 -9.76738469e+00 8.93646793e+00 32 5.84490153e+00 1.22095870e+01 1.30643738e+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 20:36:49) ===