Enter a model name: === Verification check vc-memory-leak start (2022-11-08 15:57:03) === !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! !!!!! !!!!! !!!!! 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_DeluigiPasianotValencia_2021_FeNiCrCoCu__MO_657255834688_000 Supported species : Co Cr Cu Fe Ni random seed = 13 lattice constant (orig) = 3.000 perturbation amplitude = 0.300 number unit cells per side = 2 ----------------------------------------------------------------------------------------------------- MONOATOMIC STRUCTURE (pbc=False)-- Species = Co (Configuration in file "config-F-Co.xyz") ----------------------------------------------------------------------------------------------------- Energy = -7.410660103020042 Forces: 1 -3.82128173e+00 -4.22452649e+00 -5.80829586e+00 2 -3.08068453e+00 7.29525270e+00 -6.30197221e+00 3 5.04060810e+00 -5.95479297e+00 1.70302159e+00 4 -3.91500818e+00 2.14308388e+00 1.85857309e+00 5 5.95502170e+00 -9.82691379e+00 -2.55711699e+00 6 2.11704056e+00 2.84495354e+00 -5.24538864e+00 7 -9.57792433e-02 -1.71957685e+01 -1.15266375e+01 8 -6.79614455e+00 -6.61456135e+00 8.71975151e-01 9 -6.05265975e+00 -5.19036075e+00 -9.54070048e+00 10 -8.79491516e-01 1.23502392e+01 -1.42372647e+01 11 -1.73551374e+00 -9.58704446e+00 4.96056146e+00 12 -8.94326552e+00 9.00291569e+00 3.73458717e+00 13 -3.14187715e+00 -5.71992966e+00 -1.90055266e+01 14 3.62999104e+00 6.65314485e+00 -2.94123665e+00 15 1.74960520e+01 -5.00428896e+00 5.61431876e+00 16 5.86511473e+00 1.32832283e+01 7.93438010e+00 17 -1.14434385e+01 -6.20552551e+00 -3.30559497e+00 18 3.78839148e+00 9.84651603e+00 -5.72479415e+00 19 8.95657035e-01 -1.16728902e+01 6.68255516e+00 20 -5.22986582e+00 7.88900337e+00 6.19091376e+00 21 -4.75599313e+00 -8.07581254e+00 -2.94382693e+00 22 1.30252462e+01 1.66204785e+01 1.06588424e+01 23 3.64146444e+00 -8.16882117e-01 7.12706238e+00 24 4.98485358e+00 6.37595548e+00 7.13862807e+00 25 -7.52648636e+00 -5.44665238e+00 1.36624307e+00 26 -1.15001906e-01 1.10176565e+01 -6.25679398e+00 27 1.04660901e+01 -1.87797560e+01 7.27031098e+00 28 -1.83414065e+01 1.45131915e+01 6.10269819e+00 29 -4.80664994e+00 -9.54735659e+00 2.76747795e+00 30 4.81289946e+00 9.66588964e+00 -1.32002664e+00 31 6.22763448e+00 -7.79857377e+00 6.24842056e+00 32 2.73448322e+00 8.16012690e+00 8.48460650e+00 MONOATOMIC STRUCTURE (pbc=True)-- Species = Co (Configuration in file "config-T-Co.xyz") ----------------------------------------------------------------------------------------------------- Energy = -7.410660103020042 Forces: 1 -3.82128173e+00 -4.22452649e+00 -5.80829586e+00 2 -3.08068453e+00 7.29525270e+00 -6.30197221e+00 3 5.04060810e+00 -5.95479297e+00 1.70302159e+00 4 -3.91500818e+00 2.14308388e+00 1.85857309e+00 5 5.95502170e+00 -9.82691379e+00 -2.55711699e+00 6 2.11704056e+00 2.84495354e+00 -5.24538864e+00 7 -9.57792433e-02 -1.71957685e+01 -1.15266375e+01 8 -6.79614455e+00 -6.61456135e+00 8.71975151e-01 9 -6.05265975e+00 -5.19036075e+00 -9.54070048e+00 10 -8.79491516e-01 1.23502392e+01 -1.42372647e+01 11 -1.73551374e+00 -9.58704446e+00 4.96056146e+00 12 -8.94326552e+00 9.00291569e+00 3.73458717e+00 13 -3.14187715e+00 -5.71992966e+00 -1.90055266e+01 14 3.62999104e+00 6.65314485e+00 -2.94123665e+00 15 1.74960520e+01 -5.00428896e+00 5.61431876e+00 16 5.86511473e+00 1.32832283e+01 7.93438010e+00 17 -1.14434385e+01 -6.20552551e+00 -3.30559497e+00 18 3.78839148e+00 9.84651603e+00 -5.72479415e+00 19 8.95657035e-01 -1.16728902e+01 6.68255516e+00 20 -5.22986582e+00 7.88900337e+00 6.19091376e+00 21 -4.75599313e+00 -8.07581254e+00 -2.94382693e+00 22 1.30252462e+01 1.66204785e+01 1.06588424e+01 23 3.64146444e+00 -8.16882117e-01 7.12706238e+00 24 4.98485358e+00 6.37595548e+00 7.13862807e+00 25 -7.52648636e+00 -5.44665238e+00 1.36624307e+00 26 -1.15001906e-01 1.10176565e+01 -6.25679398e+00 27 1.04660901e+01 -1.87797560e+01 7.27031098e+00 28 -1.83414065e+01 1.45131915e+01 6.10269819e+00 29 -4.80664994e+00 -9.54735659e+00 2.76747795e+00 30 4.81289946e+00 9.66588964e+00 -1.32002664e+00 31 6.22763448e+00 -7.79857377e+00 6.24842056e+00 32 2.73448322e+00 8.16012690e+00 8.48460650e+00 ERROR: Unable to perform verification check. Message = std::bad_alloc === Verification check vc-memory-leak end (2022-11-08 15:57:03) ===