!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! !!!!! !!!!! !!!!! 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_AhmadGrohGhazisaeidi_2018_MgY__MO_135739722270_000 Supported species : Mg Y random seed = 13 lattice constant (orig) = 3.000 perturbation amplitude = 0.300 number unit cells per side = 2 ----------------------------------------------------------------------------------------------------- MONOATOMIC STRUCTURE (pbc=False)-- Species = Mg (Configuration in file "config-F-Mg.xyz") ----------------------------------------------------------------------------------------------------- Energy = 184.15599826263153 Forces: 1 -5.39438484e+00 -1.12847829e+01 -9.62150195e+00 2 -3.50256409e+00 3.98600667e+00 -1.19367507e+01 3 3.05636385e+00 -1.10458250e+01 -1.77602578e+00 4 -9.91797044e+00 5.98662778e+00 5.96288257e+00 5 3.49942867e-01 -1.52261620e+01 -7.02392046e+00 6 9.27282172e+00 2.24587486e+00 -1.08632761e+01 7 7.25542767e+00 -1.70037631e+01 -8.00557751e+00 8 -5.28090063e+00 -7.22261982e+00 1.74890900e+00 9 -8.39082968e+00 -6.66448831e+00 -1.46593556e+01 10 3.40467120e+00 1.71352376e+01 -1.37962482e+01 11 -4.59902947e+00 -1.18107781e+01 -2.56556847e+00 12 -1.45111491e+01 1.29843211e+01 5.06242801e+00 13 1.89042471e-01 -2.40854433e+00 -2.31103060e+01 14 7.93514640e+00 9.10320509e+00 -8.88517867e+00 15 2.10930886e+01 -5.13710103e+00 -1.52020820e+00 16 -2.80642517e-01 2.14524741e+01 -2.46217484e+00 17 -1.56969927e+01 -8.53094426e+00 -4.40668863e+00 18 2.11850524e+00 5.92683400e+00 -5.10451668e+00 19 3.16831478e+00 -1.61668980e+01 1.06653420e+01 20 -1.00200257e+01 6.62094939e+00 1.04035073e+01 21 -6.75334954e+00 -1.28492509e+01 2.65473492e+00 22 1.77883189e+01 1.27276097e+01 8.63682088e+00 23 5.78212931e+00 -3.12245627e+00 9.58380721e+00 24 6.01980710e+00 2.68916779e+00 1.13952846e+01 25 -1.65275959e+01 -3.44116964e+00 3.90468793e+00 26 -4.83579092e+00 2.04016418e+01 -2.32831539e-01 27 2.99403293e+00 -1.40447597e+01 1.17724141e+01 28 -1.67862422e+01 1.46363106e+01 6.89600183e+00 29 1.88056917e+00 -1.08319933e+01 5.41237453e+00 30 1.11025277e+01 1.26755621e+01 5.17432335e+00 31 1.31890530e+01 -4.73564880e+00 1.00184772e+01 32 5.89770493e+00 1.29553628e+01 1.66781340e+01 MONOATOMIC STRUCTURE (pbc=True)-- Species = Mg (Configuration in file "config-T-Mg.xyz") ----------------------------------------------------------------------------------------------------- Energy = 184.15599826263153 Forces: 1 -5.39438484e+00 -1.12847829e+01 -9.62150195e+00 2 -3.50256409e+00 3.98600667e+00 -1.19367507e+01 3 3.05636385e+00 -1.10458250e+01 -1.77602578e+00 4 -9.91797044e+00 5.98662778e+00 5.96288257e+00 5 3.49942867e-01 -1.52261620e+01 -7.02392046e+00 6 9.27282172e+00 2.24587486e+00 -1.08632761e+01 7 7.25542767e+00 -1.70037631e+01 -8.00557751e+00 8 -5.28090063e+00 -7.22261982e+00 1.74890900e+00 9 -8.39082968e+00 -6.66448831e+00 -1.46593556e+01 10 3.40467120e+00 1.71352376e+01 -1.37962482e+01 11 -4.59902947e+00 -1.18107781e+01 -2.56556847e+00 12 -1.45111491e+01 1.29843211e+01 5.06242801e+00 13 1.89042471e-01 -2.40854433e+00 -2.31103060e+01 14 7.93514640e+00 9.10320509e+00 -8.88517867e+00 15 2.10930886e+01 -5.13710103e+00 -1.52020820e+00 16 -2.80642517e-01 2.14524741e+01 -2.46217484e+00 17 -1.56969927e+01 -8.53094426e+00 -4.40668863e+00 18 2.11850524e+00 5.92683400e+00 -5.10451668e+00 19 3.16831478e+00 -1.61668980e+01 1.06653420e+01 20 -1.00200257e+01 6.62094939e+00 1.04035073e+01 21 -6.75334954e+00 -1.28492509e+01 2.65473492e+00 22 1.77883189e+01 1.27276097e+01 8.63682088e+00 23 5.78212931e+00 -3.12245627e+00 9.58380721e+00 24 6.01980710e+00 2.68916779e+00 1.13952846e+01 25 -1.65275959e+01 -3.44116964e+00 3.90468793e+00 26 -4.83579092e+00 2.04016418e+01 -2.32831539e-01 27 2.99403293e+00 -1.40447597e+01 1.17724141e+01 28 -1.67862422e+01 1.46363106e+01 6.89600183e+00 29 1.88056917e+00 -1.08319933e+01 5.41237453e+00 30 1.11025277e+01 1.26755621e+01 5.17432335e+00 31 1.31890530e+01 -4.73564880e+00 1.00184772e+01 32 5.89770493e+00 1.29553628e+01 1.66781340e+01 MONOATOMIC STRUCTURE (pbc=False)-- Species = Y (Configuration in file "config-F-Y.xyz") ----------------------------------------------------------------------------------------------------- Energy = 538.7878422621226 Forces: 1 -1.98667564e+01 -1.72770762e+01 -1.25154333e+01 2 -1.24738500e+01 -2.13766280e+01 -6.87793532e+01 3 -5.45466414e+00 -3.60266726e+01 7.73271155e+00 4 -5.81425224e+01 -2.30866102e+01 -6.25162201e+00 5 1.09652638e+01 -2.95139482e+01 -2.05239192e+01 6 2.25670769e+01 3.83678122e+00 -9.11934311e+00 7 1.38445351e+01 -7.17928024e+00 1.06221994e+00 8 5.36369999e+01 -2.23235552e+01 1.97091636e+01 9 -3.48781838e+01 1.36184997e+01 -3.27944947e+01 10 -8.68439173e+00 2.52394022e+01 -8.44253517e+00 11 -1.09229673e+01 5.40273054e+01 2.40165776e+01 12 -1.72558332e+01 2.02295298e+01 -1.40849003e+01 13 1.86750932e+01 2.07119746e+00 -3.61969866e+01 14 1.87316931e+01 1.29916864e+01 -1.53916732e+01 15 1.58343984e+01 -2.94168523e+00 6.94446859e+00 16 -2.18055749e+00 2.10479932e+01 1.86410869e+01 17 -2.09226799e+01 -1.35104493e+01 -1.34596812e+01 18 -1.76245502e+01 -2.93620815e+01 2.74805837e+01 19 1.39983020e+01 -2.15108852e+01 1.87490494e+01 20 -2.30262021e+01 1.33815466e+01 1.53415918e+01 21 8.13140805e+00 -1.37644081e+01 9.21864819e-01 22 1.64414015e+01 -9.13459076e+00 -9.12072444e+00 23 8.28633990e+00 -9.49364166e+00 8.49058942e+00 24 1.01085692e+01 -1.55997815e+01 2.85681187e+01 25 -3.91347547e+01 -2.28758894e+00 -1.00056695e+01 26 2.28092448e+01 2.77483342e+01 -7.32261132e+00 27 -8.54025138e-01 2.22799108e+00 5.06475686e+01 28 -3.17156971e+01 1.51918714e+01 2.85978389e+01 29 3.71885809e+01 2.68695461e+01 -1.62654976e+01 30 1.46759624e+01 1.25244120e+01 -9.36011673e+00 31 1.90751121e+01 5.55942027e+00 1.56313412e+01 32 -1.83234526e+00 1.78233658e+01 1.70997868e+01 MONOATOMIC STRUCTURE (pbc=True)-- Species = Y (Configuration in file "config-T-Y.xyz") ----------------------------------------------------------------------------------------------------- Energy = 538.7878422621226 Forces: 1 -1.98667564e+01 -1.72770762e+01 -1.25154333e+01 2 -1.24738500e+01 -2.13766280e+01 -6.87793532e+01 3 -5.45466414e+00 -3.60266726e+01 7.73271155e+00 4 -5.81425224e+01 -2.30866102e+01 -6.25162201e+00 5 1.09652638e+01 -2.95139482e+01 -2.05239192e+01 6 2.25670769e+01 3.83678122e+00 -9.11934311e+00 7 1.38445351e+01 -7.17928024e+00 1.06221994e+00 8 5.36369999e+01 -2.23235552e+01 1.97091636e+01 9 -3.48781838e+01 1.36184997e+01 -3.27944947e+01 10 -8.68439173e+00 2.52394022e+01 -8.44253517e+00 11 -1.09229673e+01 5.40273054e+01 2.40165776e+01 12 -1.72558332e+01 2.02295298e+01 -1.40849003e+01 13 1.86750932e+01 2.07119746e+00 -3.61969866e+01 14 1.87316931e+01 1.29916864e+01 -1.53916732e+01 15 1.58343984e+01 -2.94168523e+00 6.94446859e+00 16 -2.18055749e+00 2.10479932e+01 1.86410869e+01 17 -2.09226799e+01 -1.35104493e+01 -1.34596812e+01 18 -1.76245502e+01 -2.93620815e+01 2.74805837e+01 19 1.39983020e+01 -2.15108852e+01 1.87490494e+01 20 -2.30262021e+01 1.33815466e+01 1.53415918e+01 21 8.13140805e+00 -1.37644081e+01 9.21864819e-01 22 1.64414015e+01 -9.13459076e+00 -9.12072444e+00 23 8.28633990e+00 -9.49364166e+00 8.49058942e+00 24 1.01085692e+01 -1.55997815e+01 2.85681187e+01 25 -3.91347547e+01 -2.28758894e+00 -1.00056695e+01 26 2.28092448e+01 2.77483342e+01 -7.32261132e+00 27 -8.54025138e-01 2.22799108e+00 5.06475686e+01 28 -3.17156971e+01 1.51918714e+01 2.85978389e+01 29 3.71885809e+01 2.68695461e+01 -1.62654976e+01 30 1.46759624e+01 1.25244120e+01 -9.36011673e+00 31 1.90751121e+01 5.55942027e+00 1.56313412e+01 32 -1.83234526e+00 1.78233658e+01 1.70997868e+01 MIXED STRUCTURE (pbc=False)-- Species = Mg Y (Configuration in file "config-F-MgY.xyz") ----------------------------------------------------------------------------------------------------- Energy = 370.0347227778313 Forces: 1 -2.69744448e+01 -2.98740060e+01 -1.16551358e+01 2 6.23934615e+00 1.75569967e+01 -3.17598813e+01 3 -3.86315191e+00 -1.56393832e+01 1.84643115e+01 4 -1.99225369e+01 5.94232733e+00 1.50040992e+01 5 1.01651747e+01 -2.54358075e+01 -2.54784991e+01 6 1.77989939e+01 3.14392388e+00 -2.13061494e+01 7 3.31783689e+01 -2.53056742e+01 -1.15740678e+01 8 -1.52772859e+00 1.89163655e+00 -1.28489294e+00 9 -2.71299562e+01 -4.66552137e+00 -1.84130851e+01 10 -9.58368785e+00 3.67815169e+01 -2.96247059e+01 11 -1.10523115e+01 -1.71551404e+01 1.69440300e+00 12 -1.79016227e+01 2.13413569e+01 5.19174616e+00 13 2.04080914e+01 -1.31998962e+01 -1.67375532e+01 14 7.32197912e+00 9.12636553e+00 -6.29760910e+00 15 1.46764342e+01 3.76519616e+00 5.39822516e+00 16 1.41594418e+01 2.66255368e+01 6.77207523e+00 17 -2.10162885e+01 -2.74865326e+01 -9.09555252e+00 18 1.72339719e+01 -3.43898143e+00 -3.36309844e+01 19 1.10772048e+01 -2.29067843e+01 2.16664982e+01 20 -2.62060723e+01 6.10738434e+00 2.56009273e+01 21 -1.64095609e+01 -1.98629996e+01 7.90880262e+00 22 2.13437790e+01 1.51501470e+01 7.31254810e+00 23 7.09199627e+00 -2.09377762e+01 1.90649241e+01 24 -6.86438277e+00 1.16527697e+01 7.66390971e+00 25 -1.75395192e+01 6.90554570e-01 -1.15185074e+00 26 -8.42066426e+00 1.78381050e+01 -4.71540255e+00 27 -4.97007987e+00 3.42956611e+00 3.70765629e+01 28 -1.55291406e+01 8.73190996e+00 1.38752327e+01 29 1.44766417e+01 -4.54517885e+00 5.08790180e+00 30 1.43009067e+01 1.26186997e+01 -7.45314950e+00 31 1.12647345e+01 2.80856080e+00 1.47044401e+01 32 1.41740837e+01 2.52511280e+01 1.76919114e+01 MIXED STRUCTURE (pbc=True)-- Species = Mg Y (Configuration in file "config-T-MgY.xyz") ----------------------------------------------------------------------------------------------------- Energy = 550.3195725688277 Forces: 1 -5.81092985e+00 -1.77481808e+01 -5.74183037e+00 2 -1.40400331e+00 -9.58930447e+00 3.86200698e-01 3 -9.18230198e+00 -2.15167957e+00 1.94354718e+01 4 5.30976086e+00 9.18456826e+00 1.65323973e+01 5 -2.74653131e+01 -2.10344230e+01 -1.21174174e+01 6 1.24758274e+01 1.36816285e+01 -1.19616999e+01 7 1.80296369e+01 -2.92785688e+01 -5.16281774e+00 8 -2.47232079e+00 2.34493057e+00 -1.69021774e+00 9 -1.52954081e+01 -3.66149096e+01 2.46295802e+01 10 1.36861573e+01 4.41664823e+01 3.99984375e+00 11 -1.10313529e+01 -1.79443630e+01 2.01654075e+00 12 -2.00916788e+01 2.35837722e+01 1.79955727e+01 13 3.73555112e+01 -1.05562212e+01 2.78627922e+01 14 -1.81613620e+00 4.19512279e+00 2.91257694e+00 15 -4.60720826e+00 3.61599458e+00 6.77990399e+00 16 1.64361475e+01 8.70494804e+00 1.09085579e+01 17 8.16137419e+00 -1.12753946e+01 -9.92650034e+00 18 4.40290448e+00 -6.64005664e+00 -2.40282203e+01 19 9.58650448e+00 -1.04755219e+01 3.62834668e+00 20 -7.32339195e+00 1.13034465e+01 5.26985877e+00 21 -1.47094087e+01 -1.35857916e+01 8.44038705e+00 22 4.49543961e+00 4.65296087e+01 2.01572700e+01 23 1.30639726e+01 -4.71692638e+00 -1.37563589e+00 24 -1.24800869e+01 8.84022622e+00 -5.19025493e+00 25 7.83856936e-01 -9.89899433e+00 -2.13701679e+00 26 -8.14472957e+00 1.25578275e+01 -5.35523102e+00 27 1.58290384e-01 -1.65667508e+01 -3.48381623e+01 28 -3.34175055e+00 4.60892850e+01 -5.38035398e+00 29 1.26505957e+01 -4.41581191e+00 5.25480655e+00 30 -8.90995802e+00 -2.80590324e-01 -2.49103334e+01 31 -2.06665299e+01 -3.38468822e+01 -7.93210841e+00 32 1.81565293e+01 2.18225299e+01 -1.84623066e+01 ================================================================================ VALGRIND OUTPUT ================================================================================ ==5287== Memcheck, a memory error detector ==5287== Copyright (C) 2002-2017, and GNU GPL'd, by Julian Seward et al. ==5287== Using Valgrind-3.13.0 and LibVEX; rerun with -h for copyright info ==5287== Command: python runner2.py MEAM_LAMMPS_AhmadGrohGhazisaeidi_2018_MgY__MO_135739722270_000 ==5287== ==5287== Conditional jump or move depends on uninitialised value(s) ==5287== at 0x4FCDDB7: __wcsnlen_avx2 (strlen-avx2.S:264) ==5287== by 0x4EFBCA1: wcsrtombs (wcsrtombs.c:104) ==5287== by 0x4E81C40: wcstombs (wcstombs.c:34) ==5287== by 0x5471CF: ??? (in /usr/bin/python3.6) ==5287== by 0x6330AD: _Py_stat (in /usr/bin/python3.6) ==5287== by 0x5B9C10: ??? (in /usr/bin/python3.6) ==5287== by 0x5515C0: ??? (in /usr/bin/python3.6) ==5287== by 0x5A9DAB: _PyObject_FastCallKeywords (in /usr/bin/python3.6) ==5287== by 0x50A432: ??? (in /usr/bin/python3.6) ==5287== by 0x50BEB3: _PyEval_EvalFrameDefault (in /usr/bin/python3.6) ==5287== by 0x5095C7: ??? (in /usr/bin/python3.6) ==5287== by 0x50A2FC: ??? (in /usr/bin/python3.6) ==5287== ==5287== Conditional jump or move depends on uninitialised value(s) ==5287== at 0x4E654E8: internal_utf8_loop (loop.c:298) ==5287== by 0x4E654E8: __gconv_transform_internal_utf8 (skeleton.c:609) ==5287== by 0x4EFBCD4: wcsrtombs (wcsrtombs.c:110) ==5287== by 0x4E81C40: wcstombs (wcstombs.c:34) ==5287== by 0x5471CF: ??? (in /usr/bin/python3.6) ==5287== by 0x6330AD: _Py_stat (in /usr/bin/python3.6) ==5287== by 0x5B9C10: ??? (in /usr/bin/python3.6) ==5287== by 0x5515C0: ??? (in /usr/bin/python3.6) ==5287== by 0x5A9DAB: _PyObject_FastCallKeywords (in /usr/bin/python3.6) ==5287== by 0x50A432: ??? (in /usr/bin/python3.6) ==5287== by 0x50BEB3: _PyEval_EvalFrameDefault (in /usr/bin/python3.6) ==5287== by 0x5095C7: ??? (in /usr/bin/python3.6) ==5287== by 0x50A2FC: ??? (in /usr/bin/python3.6) ==5287== ==5287== Conditional jump or move depends on uninitialised value(s) ==5287== at 0x4E654F1: internal_utf8_loop (loop.c:303) ==5287== by 0x4E654F1: __gconv_transform_internal_utf8 (skeleton.c:609) ==5287== by 0x4EFBCD4: wcsrtombs (wcsrtombs.c:110) ==5287== by 0x4E81C40: wcstombs (wcstombs.c:34) ==5287== by 0x5471CF: ??? (in /usr/bin/python3.6) ==5287== by 0x6330AD: _Py_stat (in /usr/bin/python3.6) ==5287== by 0x5B9C10: ??? (in /usr/bin/python3.6) ==5287== by 0x5515C0: ??? (in /usr/bin/python3.6) ==5287== by 0x5A9DAB: _PyObject_FastCallKeywords (in /usr/bin/python3.6) ==5287== by 0x50A432: ??? (in /usr/bin/python3.6) ==5287== by 0x50BEB3: _PyEval_EvalFrameDefault (in /usr/bin/python3.6) ==5287== by 0x5095C7: ??? (in /usr/bin/python3.6) ==5287== by 0x50A2FC: ??? (in /usr/bin/python3.6) ==5287== ==5287== Conditional jump or move depends on uninitialised value(s) ==5287== at 0x4E65538: internal_utf8_loop (loop.c:298) ==5287== by 0x4E65538: __gconv_transform_internal_utf8 (skeleton.c:609) ==5287== by 0x4EFBCD4: wcsrtombs (wcsrtombs.c:110) ==5287== by 0x4E81C40: wcstombs (wcstombs.c:34) ==5287== by 0x5471CF: ??? (in /usr/bin/python3.6) ==5287== by 0x6330AD: _Py_stat (in /usr/bin/python3.6) ==5287== by 0x5B9C10: ??? (in /usr/bin/python3.6) ==5287== by 0x5515C0: ??? (in /usr/bin/python3.6) ==5287== by 0x5A9DAB: _PyObject_FastCallKeywords (in /usr/bin/python3.6) ==5287== by 0x50A432: ??? (in /usr/bin/python3.6) ==5287== by 0x50BEB3: _PyEval_EvalFrameDefault (in /usr/bin/python3.6) ==5287== by 0x5095C7: ??? (in /usr/bin/python3.6) ==5287== by 0x50A2FC: ??? (in /usr/bin/python3.6) ==5287== ==5287== Conditional jump or move depends on uninitialised value(s) ==5287== at 0x4FCDC2C: __wcsnlen_avx2 (strlen-avx2.S:106) ==5287== by 0x4EFBCA1: wcsrtombs (wcsrtombs.c:104) ==5287== by 0x4E81C40: wcstombs (wcstombs.c:34) ==5287== by 0x5471CF: ??? (in /usr/bin/python3.6) ==5287== by 0x5474B0: PyUnicode_FSConverter (in /usr/bin/python3.6) ==5287== by 0x4CAA11: ??? (in /usr/bin/python3.6) ==5287== by 0x5515C0: ??? (in /usr/bin/python3.6) ==5287== by 0x5A9DAB: _PyObject_FastCallKeywords (in /usr/bin/python3.6) ==5287== by 0x50A432: ??? (in /usr/bin/python3.6) ==5287== by 0x50BEB3: _PyEval_EvalFrameDefault (in /usr/bin/python3.6) ==5287== by 0x5095C7: ??? (in /usr/bin/python3.6) ==5287== by 0x50A2FC: ??? (in /usr/bin/python3.6) ==5287== ==5287== Mismatched free() / delete / delete [] ==5287== at 0x4C3323B: operator delete(void*) (in /usr/lib/valgrind/vgpreload_memcheck-amd64-linux.so) ==5287== by 0x7E57B600: MEAMC::ProcessLibraryFile(_IO_FILE*, int, std::vector, std::allocator >, std::allocator, std::allocator > > > const&) (in /home/worker-user1/.kim-api/2.2.1+GNU.GNU.GNU.2021-02-02-02-50-37/model-drivers-dir/MEAM_LAMMPS__MD_249792265679_000/libkim-api-model-driver.so) ==5287== by 0x7E45D83F: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /home/worker-user1/.kim-api/2.2.1+GNU.GNU.GNU.2021-02-02-02-50-37/model-drivers-dir/MEAM_LAMMPS__MD_249792265679_000/libkim-api-model-driver.so) ==5287== by 0x7E45FCF6: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /home/worker-user1/.kim-api/2.2.1+GNU.GNU.GNU.2021-02-02-02-50-37/model-drivers-dir/MEAM_LAMMPS__MD_249792265679_000/libkim-api-model-driver.so) ==5287== by 0x7E441A01: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /home/worker-user1/.kim-api/2.2.1+GNU.GNU.GNU.2021-02-02-02-50-37/model-drivers-dir/MEAM_LAMMPS__MD_249792265679_000/libkim-api-model-driver.so) ==5287== by 0x7E442E8D: ModelDriverCreateRoutine (in /home/worker-user1/.kim-api/2.2.1+GNU.GNU.GNU.2021-02-02-02-50-37/model-drivers-dir/MEAM_LAMMPS__MD_249792265679_000/libkim-api-model-driver.so) ==5287== by 0x78A59DDF: KIM::ModelImplementation::InitializeParameterizedModel(KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, KIM::Collections*) (in /usr/local/lib/libkim-api.so.2.2.1) ==5287== by 0x78A5AF90: KIM::ModelImplementation::ModelCreate(KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&) (in /usr/local/lib/libkim-api.so.2.2.1) ==5287== by 0x78A5F20A: KIM::ModelImplementation::Create(KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&, int*, KIM::ModelImplementation**) (in /usr/local/lib/libkim-api.so.2.2.1) ==5287== by 0x78A13960: KIM::Model::Create(KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&, int*, KIM::Model**) (in /usr/local/lib/libkim-api.so.2.2.1) ==5287== by 0x78792CC7: void pybind11::cpp_function::initialize, std::allocator > const&)#15}, pybind11::tuple, KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&, pybind11::name, pybind11::scope, pybind11::sibling, pybind11::arg, pybind11::sibling, pybind11::sibling, pybind11::sibling, pybind11::sibling, pybind11::sibling, pybind11::sibling, char [45]>(pybind11_init_model(pybind11::module_&)::{lambda(KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&)#15}&&, pybind11::tuple (*)(KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&), pybind11::name const&, pybind11::scope const&, pybind11::sibling const&, pybind11::arg const&, pybind11::sibling const&, pybind11::sibling const&, pybind11::sibling const&, pybind11::sibling const&, pybind11::sibling const&, pybind11::sibling const&, char const (&) [45])::{lambda(pybind11::detail::function_call&)#3}::_FUN(pybind11::detail::function_call) (KIM_Model_bind.cpp:314) ==5287== by 0x787A191A: pybind11::cpp_function::dispatcher(_object*, _object*, _object*) (pybind11.h:767) ==5287== Address 0x559c34c0 is 0 bytes inside a block of size 1,024 alloc'd ==5287== at 0x4C3289F: operator new[](unsigned long) (in /usr/lib/valgrind/vgpreload_memcheck-amd64-linux.so) ==5287== by 0x7E57AC08: MEAMC::ProcessLibraryFile(_IO_FILE*, int, std::vector, std::allocator >, std::allocator, std::allocator > > > const&) (in /home/worker-user1/.kim-api/2.2.1+GNU.GNU.GNU.2021-02-02-02-50-37/model-drivers-dir/MEAM_LAMMPS__MD_249792265679_000/libkim-api-model-driver.so) ==5287== by 0x7E45D83F: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /home/worker-user1/.kim-api/2.2.1+GNU.GNU.GNU.2021-02-02-02-50-37/model-drivers-dir/MEAM_LAMMPS__MD_249792265679_000/libkim-api-model-driver.so) ==5287== by 0x7E45FCF6: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /home/worker-user1/.kim-api/2.2.1+GNU.GNU.GNU.2021-02-02-02-50-37/model-drivers-dir/MEAM_LAMMPS__MD_249792265679_000/libkim-api-model-driver.so) ==5287== by 0x7E441A01: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /home/worker-user1/.kim-api/2.2.1+GNU.GNU.GNU.2021-02-02-02-50-37/model-drivers-dir/MEAM_LAMMPS__MD_249792265679_000/libkim-api-model-driver.so) ==5287== by 0x7E442E8D: ModelDriverCreateRoutine (in /home/worker-user1/.kim-api/2.2.1+GNU.GNU.GNU.2021-02-02-02-50-37/model-drivers-dir/MEAM_LAMMPS__MD_249792265679_000/libkim-api-model-driver.so) ==5287== by 0x78A59DDF: KIM::ModelImplementation::InitializeParameterizedModel(KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, KIM::Collections*) (in /usr/local/lib/libkim-api.so.2.2.1) ==5287== by 0x78A5AF90: KIM::ModelImplementation::ModelCreate(KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&) (in /usr/local/lib/libkim-api.so.2.2.1) ==5287== by 0x78A5F20A: KIM::ModelImplementation::Create(KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&, int*, KIM::ModelImplementation**) (in /usr/local/lib/libkim-api.so.2.2.1) ==5287== by 0x78A13960: KIM::Model::Create(KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&, int*, KIM::Model**) (in /usr/local/lib/libkim-api.so.2.2.1) ==5287== by 0x78792CC7: void pybind11::cpp_function::initialize, std::allocator > const&)#15}, pybind11::tuple, KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&, pybind11::name, pybind11::scope, pybind11::sibling, pybind11::arg, pybind11::sibling, pybind11::sibling, pybind11::sibling, pybind11::sibling, pybind11::sibling, pybind11::sibling, char [45]>(pybind11_init_model(pybind11::module_&)::{lambda(KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&)#15}&&, pybind11::tuple (*)(KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&), pybind11::name const&, pybind11::scope const&, pybind11::sibling const&, pybind11::arg const&, pybind11::sibling const&, pybind11::sibling const&, pybind11::sibling const&, pybind11::sibling const&, pybind11::sibling const&, pybind11::sibling const&, char const (&) [45])::{lambda(pybind11::detail::function_call&)#3}::_FUN(pybind11::detail::function_call) (KIM_Model_bind.cpp:314) ==5287== by 0x787A191A: pybind11::cpp_function::dispatcher(_object*, _object*, _object*) (pybind11.h:767) ==5287== ==5287== Mismatched free() / delete / delete [] ==5287== at 0x4C3323B: operator delete(void*) (in /usr/lib/valgrind/vgpreload_memcheck-amd64-linux.so) ==5287== by 0x7E575848: MEAMC::ProcessParameterFile(_IO_FILE*, int) (in /home/worker-user1/.kim-api/2.2.1+GNU.GNU.GNU.2021-02-02-02-50-37/model-drivers-dir/MEAM_LAMMPS__MD_249792265679_000/libkim-api-model-driver.so) ==5287== by 0x7E45D86E: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /home/worker-user1/.kim-api/2.2.1+GNU.GNU.GNU.2021-02-02-02-50-37/model-drivers-dir/MEAM_LAMMPS__MD_249792265679_000/libkim-api-model-driver.so) ==5287== by 0x7E45FCF6: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /home/worker-user1/.kim-api/2.2.1+GNU.GNU.GNU.2021-02-02-02-50-37/model-drivers-dir/MEAM_LAMMPS__MD_249792265679_000/libkim-api-model-driver.so) ==5287== by 0x7E441A01: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /home/worker-user1/.kim-api/2.2.1+GNU.GNU.GNU.2021-02-02-02-50-37/model-drivers-dir/MEAM_LAMMPS__MD_249792265679_000/libkim-api-model-driver.so) ==5287== by 0x7E442E8D: ModelDriverCreateRoutine (in /home/worker-user1/.kim-api/2.2.1+GNU.GNU.GNU.2021-02-02-02-50-37/model-drivers-dir/MEAM_LAMMPS__MD_249792265679_000/libkim-api-model-driver.so) ==5287== by 0x78A59DDF: KIM::ModelImplementation::InitializeParameterizedModel(KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, KIM::Collections*) (in /usr/local/lib/libkim-api.so.2.2.1) ==5287== by 0x78A5AF90: KIM::ModelImplementation::ModelCreate(KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&) (in /usr/local/lib/libkim-api.so.2.2.1) ==5287== by 0x78A5F20A: KIM::ModelImplementation::Create(KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&, int*, KIM::ModelImplementation**) (in /usr/local/lib/libkim-api.so.2.2.1) ==5287== by 0x78A13960: KIM::Model::Create(KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&, int*, KIM::Model**) (in /usr/local/lib/libkim-api.so.2.2.1) ==5287== by 0x78792CC7: void pybind11::cpp_function::initialize, std::allocator > const&)#15}, pybind11::tuple, KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&, pybind11::name, pybind11::scope, pybind11::sibling, pybind11::arg, pybind11::sibling, pybind11::sibling, pybind11::sibling, pybind11::sibling, pybind11::sibling, pybind11::sibling, char [45]>(pybind11_init_model(pybind11::module_&)::{lambda(KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&)#15}&&, pybind11::tuple (*)(KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&), pybind11::name const&, pybind11::scope const&, pybind11::sibling const&, pybind11::arg const&, pybind11::sibling const&, pybind11::sibling const&, pybind11::sibling const&, pybind11::sibling const&, pybind11::sibling const&, pybind11::sibling const&, char const (&) [45])::{lambda(pybind11::detail::function_call&)#3}::_FUN(pybind11::detail::function_call) (KIM_Model_bind.cpp:314) ==5287== by 0x787A191A: pybind11::cpp_function::dispatcher(_object*, _object*, _object*) (pybind11.h:767) ==5287== Address 0x559c4700 is 0 bytes inside a block of size 1,024 alloc'd ==5287== at 0x4C3289F: operator new[](unsigned long) (in /usr/lib/valgrind/vgpreload_memcheck-amd64-linux.so) ==5287== by 0x7E57564A: MEAMC::ProcessParameterFile(_IO_FILE*, int) (in /home/worker-user1/.kim-api/2.2.1+GNU.GNU.GNU.2021-02-02-02-50-37/model-drivers-dir/MEAM_LAMMPS__MD_249792265679_000/libkim-api-model-driver.so) ==5287== by 0x7E45D86E: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /home/worker-user1/.kim-api/2.2.1+GNU.GNU.GNU.2021-02-02-02-50-37/model-drivers-dir/MEAM_LAMMPS__MD_249792265679_000/libkim-api-model-driver.so) ==5287== by 0x7E45FCF6: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /home/worker-user1/.kim-api/2.2.1+GNU.GNU.GNU.2021-02-02-02-50-37/model-drivers-dir/MEAM_LAMMPS__MD_249792265679_000/libkim-api-model-driver.so) ==5287== by 0x7E441A01: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /home/worker-user1/.kim-api/2.2.1+GNU.GNU.GNU.2021-02-02-02-50-37/model-drivers-dir/MEAM_LAMMPS__MD_249792265679_000/libkim-api-model-driver.so) ==5287== by 0x7E442E8D: ModelDriverCreateRoutine (in /home/worker-user1/.kim-api/2.2.1+GNU.GNU.GNU.2021-02-02-02-50-37/model-drivers-dir/MEAM_LAMMPS__MD_249792265679_000/libkim-api-model-driver.so) ==5287== by 0x78A59DDF: KIM::ModelImplementation::InitializeParameterizedModel(KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, KIM::Collections*) (in /usr/local/lib/libkim-api.so.2.2.1) ==5287== by 0x78A5AF90: KIM::ModelImplementation::ModelCreate(KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&) (in /usr/local/lib/libkim-api.so.2.2.1) ==5287== by 0x78A5F20A: KIM::ModelImplementation::Create(KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&, int*, KIM::ModelImplementation**) (in /usr/local/lib/libkim-api.so.2.2.1) ==5287== by 0x78A13960: KIM::Model::Create(KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&, int*, KIM::Model**) (in /usr/local/lib/libkim-api.so.2.2.1) ==5287== by 0x78792CC7: void pybind11::cpp_function::initialize, std::allocator > const&)#15}, pybind11::tuple, KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&, pybind11::name, pybind11::scope, pybind11::sibling, pybind11::arg, pybind11::sibling, pybind11::sibling, pybind11::sibling, pybind11::sibling, pybind11::sibling, pybind11::sibling, char [45]>(pybind11_init_model(pybind11::module_&)::{lambda(KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&)#15}&&, pybind11::tuple (*)(KIM::Numbering, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, std::__cxx11::basic_string, std::allocator > const&), pybind11::name const&, pybind11::scope const&, pybind11::sibling const&, pybind11::arg const&, pybind11::sibling const&, pybind11::sibling const&, pybind11::sibling const&, pybind11::sibling const&, pybind11::sibling const&, pybind11::sibling const&, char const (&) [45])::{lambda(pybind11::detail::function_call&)#3}::_FUN(pybind11::detail::function_call) (KIM_Model_bind.cpp:314) ==5287== by 0x787A191A: pybind11::cpp_function::dispatcher(_object*, _object*, _object*) (pybind11.h:767) ==5287== ==5287== ==5287== HEAP SUMMARY: ==5287== in use at exit: 2,776,687 bytes in 1,540 blocks ==5287== total heap usage: 93,485 allocs, 91,945 frees, 119,938,622 bytes allocated ==5287== ==5287== LEAK SUMMARY: ==5287== definitely lost: 0 bytes in 0 blocks ==5287== indirectly lost: 0 bytes in 0 blocks ==5287== possibly lost: 145,616 bytes in 85 blocks ==5287== still reachable: 2,631,071 bytes in 1,455 blocks ==5287== suppressed: 0 bytes in 0 blocks ==5287== Rerun with --leak-check=full to see details of leaked memory ==5287== ==5287== For counts of detected and suppressed errors, rerun with: -v ==5287== Use --track-origins=yes to see where uninitialised values come from ==5287== ERROR SUMMARY: 6692 errors from 7 contexts (suppressed: 11898 from 674) ================================================================================ To pass this verification check the number of bytes that are "definitely lost" or "indirectly lost" must be zero. NOTE that Valgrind will typically report non-zero "possibly lost" bytes due to Python's internal memory allocation and garbage collection that it does not monitor. Full Valgrind output written to auxiliary file "valgrind.out" Grade: P Comment: No memory leak detected.