!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! !!!!! !!!!! !!!!! 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_FuemmelerVita_2023_Li__MO_386038428339_000 Supported species : Li random seed = 13 lattice constant (orig) = 3.000 perturbation amplitude = 0.300 number unit cells per side = 2 ----------------------------------------------------------------------------------------------------- MONOATOMIC STRUCTURE (pbc=False)-- Species = Li (Configuration in file "config-F-Li.xyz") ----------------------------------------------------------------------------------------------------- Energy = -12.748934278445374 Forces: 1 -1.17204916e+00 -7.80132162e-01 -1.16370202e+00 2 3.60763366e-01 -1.59747215e-01 -2.60166754e+00 3 -3.24587952e-01 -2.66779316e+00 1.85748813e-01 4 -2.75358594e+00 -1.42891728e-01 -4.19504585e-01 5 -7.42977785e-02 -1.66994858e+00 -1.40836068e+00 6 1.73061122e+00 -3.33741968e-01 -1.95635963e+00 7 1.23028069e+00 -1.29004352e+00 -8.67103235e-02 8 -3.18898894e-01 -1.32595450e-02 4.43778304e-01 9 -1.35718014e+00 3.10147364e-01 -1.63215682e+00 10 1.81157678e-01 1.86329202e+00 -1.55991162e+00 11 -4.61262734e-01 -8.14313415e-01 -3.12734434e-01 12 -1.78096549e+00 1.57491959e+00 -9.83581977e-02 13 5.89396201e-01 4.85685151e-01 -1.96351259e+00 14 1.54906180e+00 1.09279139e+00 -1.13905912e+00 15 1.78089560e+00 2.34913493e-01 -2.04665571e-01 16 -7.15180817e-01 2.26822361e+00 1.76764566e-01 17 -1.69029963e+00 -1.30099788e+00 5.81656970e-02 18 -2.22059777e-01 -3.26610105e-02 1.93861801e-01 19 1.53528631e-01 -1.76932382e+00 1.51960949e+00 20 -1.27801867e+00 3.33225795e-01 1.30712142e+00 21 6.77633714e-01 -2.47799564e+00 5.30540695e-01 22 2.40390950e+00 -1.43133381e-01 3.51897236e-01 23 9.65917903e-01 -6.25508793e-01 1.12427103e+00 24 1.22792826e-01 -1.81589244e-01 2.27618983e+00 25 -1.84291710e+00 4.66956161e-02 1.36644462e-01 26 2.71246550e-01 2.52359590e+00 -1.95322132e-01 27 -9.83592303e-01 -3.02507225e-02 1.99319195e+00 28 -1.18539288e+00 8.15064080e-01 1.16263568e+00 29 3.40076605e-01 -6.06550160e-01 2.50691161e-01 30 2.13073509e+00 1.64517840e+00 -1.40402903e-02 31 1.58157181e+00 1.16027098e-01 1.07405615e+00 32 9.07100522e-02 1.73012243e+00 1.97089727e+00 MONOATOMIC STRUCTURE (pbc=True)-- Species = Li (Configuration in file "config-T-Li.xyz") ----------------------------------------------------------------------------------------------------- Energy = -12.748934278445374 Forces: 1 -1.17204916e+00 -7.80132162e-01 -1.16370202e+00 2 3.60763366e-01 -1.59747215e-01 -2.60166754e+00 3 -3.24587952e-01 -2.66779316e+00 1.85748813e-01 4 -2.75358594e+00 -1.42891728e-01 -4.19504585e-01 5 -7.42977785e-02 -1.66994858e+00 -1.40836068e+00 6 1.73061122e+00 -3.33741968e-01 -1.95635963e+00 7 1.23028069e+00 -1.29004352e+00 -8.67103235e-02 8 -3.18898894e-01 -1.32595450e-02 4.43778304e-01 9 -1.35718014e+00 3.10147364e-01 -1.63215682e+00 10 1.81157678e-01 1.86329202e+00 -1.55991162e+00 11 -4.61262734e-01 -8.14313415e-01 -3.12734434e-01 12 -1.78096549e+00 1.57491959e+00 -9.83581977e-02 13 5.89396201e-01 4.85685151e-01 -1.96351259e+00 14 1.54906180e+00 1.09279139e+00 -1.13905912e+00 15 1.78089560e+00 2.34913493e-01 -2.04665571e-01 16 -7.15180817e-01 2.26822361e+00 1.76764566e-01 17 -1.69029963e+00 -1.30099788e+00 5.81656970e-02 18 -2.22059777e-01 -3.26610105e-02 1.93861801e-01 19 1.53528631e-01 -1.76932382e+00 1.51960949e+00 20 -1.27801867e+00 3.33225795e-01 1.30712142e+00 21 6.77633714e-01 -2.47799564e+00 5.30540695e-01 22 2.40390950e+00 -1.43133381e-01 3.51897236e-01 23 9.65917903e-01 -6.25508793e-01 1.12427103e+00 24 1.22792826e-01 -1.81589244e-01 2.27618983e+00 25 -1.84291710e+00 4.66956161e-02 1.36644462e-01 26 2.71246550e-01 2.52359590e+00 -1.95322132e-01 27 -9.83592303e-01 -3.02507225e-02 1.99319195e+00 28 -1.18539288e+00 8.15064080e-01 1.16263568e+00 29 3.40076605e-01 -6.06550160e-01 2.50691161e-01 30 2.13073509e+00 1.64517840e+00 -1.40402903e-02 31 1.58157181e+00 1.16027098e-01 1.07405615e+00 32 9.07100522e-02 1.73012243e+00 1.97089727e+00 ================================================================================ VALGRIND OUTPUT ================================================================================ ==3256561== Memcheck, a memory error detector ==3256561== Copyright (C) 2002-2017, and GNU GPL'd, by Julian Seward et al. ==3256561== Using Valgrind-3.15.0 and LibVEX; rerun with -h for copyright info ==3256561== Command: python runner2.py MEAM_LAMMPS_FuemmelerVita_2023_Li__MO_386038428339_000 ==3256561== ==3256561== Mismatched free() / delete / delete [] ==3256561== at 0x483CFBF: operator delete(void*) (in /usr/lib/x86_64-linux-gnu/valgrind/vgpreload_memcheck-amd64-linux.so) ==3256561== by 0x14BDC216F: Spline::ProcessParameterFile(_IO_FILE*, int, bool) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BE7D074: MEAMSpline::ProcessPotentialFile(_IO_FILE*, int, std::vector, std::allocator >, std::allocator, std::allocator > > > const&) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD5EAE8: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD60C23: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD49DB7: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD4D59E: ModelDriverCreateRoutine (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14B5C5F1E: 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) ==3256561== by 0x14B5C6E18: 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) ==3256561== by 0x14B5CB762: 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) ==3256561== by 0x14B57B246: 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) ==3256561== by 0x14B4DB647: void pybind11::cpp_function::initialize, std::allocator > const&)#21}, pybind11::tuple, KIM::Numbering const&, KIM::LengthUnit const&, KIM::EnergyUnit const&, KIM::ChargeUnit const&, KIM::TemperatureUnit const&, KIM::TimeUnit const&, std::__cxx11::basic_string, std::allocator > const&, pybind11::name, pybind11::scope, pybind11::sibling, char [115], pybind11::arg, char [115], char [115], char [115], char [115], char [115], char [115]>(pybind11_init_model(pybind11::module_&)::{lambda(KIM::Numbering const&, KIM::LengthUnit const&, KIM::EnergyUnit const&, KIM::ChargeUnit const&, KIM::TemperatureUnit const&, KIM::TimeUnit const&, std::__cxx11::basic_string, std::allocator > const&)#21}&&, pybind11::tuple (*)(KIM::Numbering const&, KIM::LengthUnit const&, KIM::EnergyUnit const&, KIM::ChargeUnit const&, KIM::TemperatureUnit const&, KIM::TimeUnit const&, std::__cxx11::basic_string, std::allocator > const&), pybind11::name const&, pybind11::scope const&, pybind11::sibling const&, char const (&) [115], pybind11::arg const&, char const (&) [115], char const (&) [115], char const (&) [115], char const (&) [115], char const (&) [115], char const (&) [115])::{lambda(pybind11::detail::function_call&)#3}::_FUN(pybind11::detail::function_call) (KIM_Model_bind.cpp:400) ==3256561== Address 0x14b074050 is 0 bytes inside a block of size 1,024 alloc'd ==3256561== at 0x483C583: operator new[](unsigned long) (in /usr/lib/x86_64-linux-gnu/valgrind/vgpreload_memcheck-amd64-linux.so) ==3256561== by 0x14BDC1D50: Spline::ProcessParameterFile(_IO_FILE*, int, bool) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BE7D074: MEAMSpline::ProcessPotentialFile(_IO_FILE*, int, std::vector, std::allocator >, std::allocator, std::allocator > > > const&) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD5EAE8: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD60C23: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD49DB7: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD4D59E: ModelDriverCreateRoutine (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14B5C5F1E: 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) ==3256561== by 0x14B5C6E18: 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) ==3256561== by 0x14B5CB762: 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) ==3256561== by 0x14B57B246: 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) ==3256561== by 0x14B4DB647: void pybind11::cpp_function::initialize, std::allocator > const&)#21}, pybind11::tuple, KIM::Numbering const&, KIM::LengthUnit const&, KIM::EnergyUnit const&, KIM::ChargeUnit const&, KIM::TemperatureUnit const&, KIM::TimeUnit const&, std::__cxx11::basic_string, std::allocator > const&, pybind11::name, pybind11::scope, pybind11::sibling, char [115], pybind11::arg, char [115], char [115], char [115], char [115], char [115], char [115]>(pybind11_init_model(pybind11::module_&)::{lambda(KIM::Numbering const&, KIM::LengthUnit const&, KIM::EnergyUnit const&, KIM::ChargeUnit const&, KIM::TemperatureUnit const&, KIM::TimeUnit const&, std::__cxx11::basic_string, std::allocator > const&)#21}&&, pybind11::tuple (*)(KIM::Numbering const&, KIM::LengthUnit const&, KIM::EnergyUnit const&, KIM::ChargeUnit const&, KIM::TemperatureUnit const&, KIM::TimeUnit const&, std::__cxx11::basic_string, std::allocator > const&), pybind11::name const&, pybind11::scope const&, pybind11::sibling const&, char const (&) [115], pybind11::arg const&, char const (&) [115], char const (&) [115], char const (&) [115], char const (&) [115], char const (&) [115], char const (&) [115])::{lambda(pybind11::detail::function_call&)#3}::_FUN(pybind11::detail::function_call) (KIM_Model_bind.cpp:400) ==3256561== ==3256561== Mismatched free() / delete / delete [] ==3256561== at 0x483CFBF: operator delete(void*) (in /usr/lib/x86_64-linux-gnu/valgrind/vgpreload_memcheck-amd64-linux.so) ==3256561== by 0x14BDC216F: Spline::ProcessParameterFile(_IO_FILE*, int, bool) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BE7E328: MEAMSpline::ProcessPotentialFile(_IO_FILE*, int, std::vector, std::allocator >, std::allocator, std::allocator > > > const&) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD5EAE8: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD60C23: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD49DB7: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD4D59E: ModelDriverCreateRoutine (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14B5C5F1E: 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) ==3256561== by 0x14B5C6E18: 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) ==3256561== by 0x14B5CB762: 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) ==3256561== by 0x14B57B246: 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) ==3256561== by 0x14B4DB647: void pybind11::cpp_function::initialize, std::allocator > const&)#21}, pybind11::tuple, KIM::Numbering const&, KIM::LengthUnit const&, KIM::EnergyUnit const&, KIM::ChargeUnit const&, KIM::TemperatureUnit const&, KIM::TimeUnit const&, std::__cxx11::basic_string, std::allocator > const&, pybind11::name, pybind11::scope, pybind11::sibling, char [115], pybind11::arg, char [115], char [115], char [115], char [115], char [115], char [115]>(pybind11_init_model(pybind11::module_&)::{lambda(KIM::Numbering const&, KIM::LengthUnit const&, KIM::EnergyUnit const&, KIM::ChargeUnit const&, KIM::TemperatureUnit const&, KIM::TimeUnit const&, std::__cxx11::basic_string, std::allocator > const&)#21}&&, pybind11::tuple (*)(KIM::Numbering const&, KIM::LengthUnit const&, KIM::EnergyUnit const&, KIM::ChargeUnit const&, KIM::TemperatureUnit const&, KIM::TimeUnit const&, std::__cxx11::basic_string, std::allocator > const&), pybind11::name const&, pybind11::scope const&, pybind11::sibling const&, char const (&) [115], pybind11::arg const&, char const (&) [115], char const (&) [115], char const (&) [115], char const (&) [115], char const (&) [115], char const (&) [115])::{lambda(pybind11::detail::function_call&)#3}::_FUN(pybind11::detail::function_call) (KIM_Model_bind.cpp:400) ==3256561== Address 0x14b074690 is 0 bytes inside a block of size 1,024 alloc'd ==3256561== at 0x483C583: operator new[](unsigned long) (in /usr/lib/x86_64-linux-gnu/valgrind/vgpreload_memcheck-amd64-linux.so) ==3256561== by 0x14BDC1D50: Spline::ProcessParameterFile(_IO_FILE*, int, bool) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BE7E328: MEAMSpline::ProcessPotentialFile(_IO_FILE*, int, std::vector, std::allocator >, std::allocator, std::allocator > > > const&) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD5EAE8: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD60C23: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD49DB7: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD4D59E: ModelDriverCreateRoutine (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14B5C5F1E: 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) ==3256561== by 0x14B5C6E18: 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) ==3256561== by 0x14B5CB762: 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) ==3256561== by 0x14B57B246: 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) ==3256561== by 0x14B4DB647: void pybind11::cpp_function::initialize, std::allocator > const&)#21}, pybind11::tuple, KIM::Numbering const&, KIM::LengthUnit const&, KIM::EnergyUnit const&, KIM::ChargeUnit const&, KIM::TemperatureUnit const&, KIM::TimeUnit const&, std::__cxx11::basic_string, std::allocator > const&, pybind11::name, pybind11::scope, pybind11::sibling, char [115], pybind11::arg, char [115], char [115], char [115], char [115], char [115], char [115]>(pybind11_init_model(pybind11::module_&)::{lambda(KIM::Numbering const&, KIM::LengthUnit const&, KIM::EnergyUnit const&, KIM::ChargeUnit const&, KIM::TemperatureUnit const&, KIM::TimeUnit const&, std::__cxx11::basic_string, std::allocator > const&)#21}&&, pybind11::tuple (*)(KIM::Numbering const&, KIM::LengthUnit const&, KIM::EnergyUnit const&, KIM::ChargeUnit const&, KIM::TemperatureUnit const&, KIM::TimeUnit const&, std::__cxx11::basic_string, std::allocator > const&), pybind11::name const&, pybind11::scope const&, pybind11::sibling const&, char const (&) [115], pybind11::arg const&, char const (&) [115], char const (&) [115], char const (&) [115], char const (&) [115], char const (&) [115], char const (&) [115])::{lambda(pybind11::detail::function_call&)#3}::_FUN(pybind11::detail::function_call) (KIM_Model_bind.cpp:400) ==3256561== ==3256561== Mismatched free() / delete / delete [] ==3256561== at 0x483CFBF: operator delete(void*) (in /usr/lib/x86_64-linux-gnu/valgrind/vgpreload_memcheck-amd64-linux.so) ==3256561== by 0x14BDC216F: Spline::ProcessParameterFile(_IO_FILE*, int, bool) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BE7E49C: MEAMSpline::ProcessPotentialFile(_IO_FILE*, int, std::vector, std::allocator >, std::allocator, std::allocator > > > const&) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD5EAE8: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD60C23: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD49DB7: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD4D59E: ModelDriverCreateRoutine (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14B5C5F1E: 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) ==3256561== by 0x14B5C6E18: 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) ==3256561== by 0x14B5CB762: 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) ==3256561== by 0x14B57B246: 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) ==3256561== by 0x14B4DB647: void pybind11::cpp_function::initialize, std::allocator > const&)#21}, pybind11::tuple, KIM::Numbering const&, KIM::LengthUnit const&, KIM::EnergyUnit const&, KIM::ChargeUnit const&, KIM::TemperatureUnit const&, KIM::TimeUnit const&, std::__cxx11::basic_string, std::allocator > const&, pybind11::name, pybind11::scope, pybind11::sibling, char [115], pybind11::arg, char [115], char [115], char [115], char [115], char [115], char [115]>(pybind11_init_model(pybind11::module_&)::{lambda(KIM::Numbering const&, KIM::LengthUnit const&, KIM::EnergyUnit const&, KIM::ChargeUnit const&, KIM::TemperatureUnit const&, KIM::TimeUnit const&, std::__cxx11::basic_string, std::allocator > const&)#21}&&, pybind11::tuple (*)(KIM::Numbering const&, KIM::LengthUnit const&, KIM::EnergyUnit const&, KIM::ChargeUnit const&, KIM::TemperatureUnit const&, KIM::TimeUnit const&, std::__cxx11::basic_string, std::allocator > const&), pybind11::name const&, pybind11::scope const&, pybind11::sibling const&, char const (&) [115], pybind11::arg const&, char const (&) [115], char const (&) [115], char const (&) [115], char const (&) [115], char const (&) [115], char const (&) [115])::{lambda(pybind11::detail::function_call&)#3}::_FUN(pybind11::detail::function_call) (KIM_Model_bind.cpp:400) ==3256561== Address 0x14b074ad0 is 0 bytes inside a block of size 1,024 alloc'd ==3256561== at 0x483C583: operator new[](unsigned long) (in /usr/lib/x86_64-linux-gnu/valgrind/vgpreload_memcheck-amd64-linux.so) ==3256561== by 0x14BDC1D50: Spline::ProcessParameterFile(_IO_FILE*, int, bool) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BE7E49C: MEAMSpline::ProcessPotentialFile(_IO_FILE*, int, std::vector, std::allocator >, std::allocator, std::allocator > > > const&) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD5EAE8: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD60C23: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD49DB7: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD4D59E: ModelDriverCreateRoutine (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14B5C5F1E: 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) ==3256561== by 0x14B5C6E18: 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) ==3256561== by 0x14B5CB762: 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) ==3256561== by 0x14B57B246: 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) ==3256561== by 0x14B4DB647: void pybind11::cpp_function::initialize, std::allocator > const&)#21}, pybind11::tuple, KIM::Numbering const&, KIM::LengthUnit const&, KIM::EnergyUnit const&, KIM::ChargeUnit const&, KIM::TemperatureUnit const&, KIM::TimeUnit const&, std::__cxx11::basic_string, std::allocator > const&, pybind11::name, pybind11::scope, pybind11::sibling, char [115], pybind11::arg, char [115], char [115], char [115], char [115], char [115], char [115]>(pybind11_init_model(pybind11::module_&)::{lambda(KIM::Numbering const&, KIM::LengthUnit const&, KIM::EnergyUnit const&, KIM::ChargeUnit const&, KIM::TemperatureUnit const&, KIM::TimeUnit const&, std::__cxx11::basic_string, std::allocator > const&)#21}&&, pybind11::tuple (*)(KIM::Numbering const&, KIM::LengthUnit const&, KIM::EnergyUnit const&, KIM::ChargeUnit const&, KIM::TemperatureUnit const&, KIM::TimeUnit const&, std::__cxx11::basic_string, std::allocator > const&), pybind11::name const&, pybind11::scope const&, pybind11::sibling const&, char const (&) [115], pybind11::arg const&, char const (&) [115], char const (&) [115], char const (&) [115], char const (&) [115], char const (&) [115], char const (&) [115])::{lambda(pybind11::detail::function_call&)#3}::_FUN(pybind11::detail::function_call) (KIM_Model_bind.cpp:400) ==3256561== ==3256561== Mismatched free() / delete / delete [] ==3256561== at 0x483CFBF: operator delete(void*) (in /usr/lib/x86_64-linux-gnu/valgrind/vgpreload_memcheck-amd64-linux.so) ==3256561== by 0x14BDC216F: Spline::ProcessParameterFile(_IO_FILE*, int, bool) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BE7E72B: MEAMSpline::ProcessPotentialFile(_IO_FILE*, int, std::vector, std::allocator >, std::allocator, std::allocator > > > const&) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD5EAE8: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD60C23: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD49DB7: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD4D59E: ModelDriverCreateRoutine (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14B5C5F1E: 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) ==3256561== by 0x14B5C6E18: 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) ==3256561== by 0x14B5CB762: 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) ==3256561== by 0x14B57B246: 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) ==3256561== by 0x14B4DB647: void pybind11::cpp_function::initialize, std::allocator > const&)#21}, pybind11::tuple, KIM::Numbering const&, KIM::LengthUnit const&, KIM::EnergyUnit const&, KIM::ChargeUnit const&, KIM::TemperatureUnit const&, KIM::TimeUnit const&, std::__cxx11::basic_string, std::allocator > const&, pybind11::name, pybind11::scope, pybind11::sibling, char [115], pybind11::arg, char [115], char [115], char [115], char [115], char [115], char [115]>(pybind11_init_model(pybind11::module_&)::{lambda(KIM::Numbering const&, KIM::LengthUnit const&, KIM::EnergyUnit const&, KIM::ChargeUnit const&, KIM::TemperatureUnit const&, KIM::TimeUnit const&, std::__cxx11::basic_string, std::allocator > const&)#21}&&, pybind11::tuple (*)(KIM::Numbering const&, KIM::LengthUnit const&, KIM::EnergyUnit const&, KIM::ChargeUnit const&, KIM::TemperatureUnit const&, KIM::TimeUnit const&, std::__cxx11::basic_string, std::allocator > const&), pybind11::name const&, pybind11::scope const&, pybind11::sibling const&, char const (&) [115], pybind11::arg const&, char const (&) [115], char const (&) [115], char const (&) [115], char const (&) [115], char const (&) [115], char const (&) [115])::{lambda(pybind11::detail::function_call&)#3}::_FUN(pybind11::detail::function_call) (KIM_Model_bind.cpp:400) ==3256561== Address 0x14b074f90 is 0 bytes inside a block of size 1,024 alloc'd ==3256561== at 0x483C583: operator new[](unsigned long) (in /usr/lib/x86_64-linux-gnu/valgrind/vgpreload_memcheck-amd64-linux.so) ==3256561== by 0x14BDC1D50: Spline::ProcessParameterFile(_IO_FILE*, int, bool) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BE7E72B: MEAMSpline::ProcessPotentialFile(_IO_FILE*, int, std::vector, std::allocator >, std::allocator, std::allocator > > > const&) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD5EAE8: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD60C23: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD49DB7: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD4D59E: ModelDriverCreateRoutine (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14B5C5F1E: 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) ==3256561== by 0x14B5C6E18: 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) ==3256561== by 0x14B5CB762: 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) ==3256561== by 0x14B57B246: 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) ==3256561== by 0x14B4DB647: void pybind11::cpp_function::initialize, std::allocator > const&)#21}, pybind11::tuple, KIM::Numbering const&, KIM::LengthUnit const&, KIM::EnergyUnit const&, KIM::ChargeUnit const&, KIM::TemperatureUnit const&, KIM::TimeUnit const&, std::__cxx11::basic_string, std::allocator > const&, pybind11::name, pybind11::scope, pybind11::sibling, char [115], pybind11::arg, char [115], char [115], char [115], char [115], char [115], char [115]>(pybind11_init_model(pybind11::module_&)::{lambda(KIM::Numbering const&, KIM::LengthUnit const&, KIM::EnergyUnit const&, KIM::ChargeUnit const&, KIM::TemperatureUnit const&, KIM::TimeUnit const&, std::__cxx11::basic_string, std::allocator > const&)#21}&&, pybind11::tuple (*)(KIM::Numbering const&, KIM::LengthUnit const&, KIM::EnergyUnit const&, KIM::ChargeUnit const&, KIM::TemperatureUnit const&, KIM::TimeUnit const&, std::__cxx11::basic_string, std::allocator > const&), pybind11::name const&, pybind11::scope const&, pybind11::sibling const&, char const (&) [115], pybind11::arg const&, char const (&) [115], char const (&) [115], char const (&) [115], char const (&) [115], char const (&) [115], char const (&) [115])::{lambda(pybind11::detail::function_call&)#3}::_FUN(pybind11::detail::function_call) (KIM_Model_bind.cpp:400) ==3256561== ==3256561== Mismatched free() / delete / delete [] ==3256561== at 0x483CFBF: operator delete(void*) (in /usr/lib/x86_64-linux-gnu/valgrind/vgpreload_memcheck-amd64-linux.so) ==3256561== by 0x14BDC216F: Spline::ProcessParameterFile(_IO_FILE*, int, bool) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BE7EA1A: MEAMSpline::ProcessPotentialFile(_IO_FILE*, int, std::vector, std::allocator >, std::allocator, std::allocator > > > const&) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD5EAE8: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD60C23: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD49DB7: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD4D59E: ModelDriverCreateRoutine (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14B5C5F1E: 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) ==3256561== by 0x14B5C6E18: 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) ==3256561== by 0x14B5CB762: 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) ==3256561== by 0x14B57B246: 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) ==3256561== by 0x14B4DB647: void pybind11::cpp_function::initialize, std::allocator > const&)#21}, pybind11::tuple, KIM::Numbering const&, KIM::LengthUnit const&, KIM::EnergyUnit const&, KIM::ChargeUnit const&, KIM::TemperatureUnit const&, KIM::TimeUnit const&, std::__cxx11::basic_string, std::allocator > const&, pybind11::name, pybind11::scope, pybind11::sibling, char [115], pybind11::arg, char [115], char [115], char [115], char [115], char [115], char [115]>(pybind11_init_model(pybind11::module_&)::{lambda(KIM::Numbering const&, KIM::LengthUnit const&, KIM::EnergyUnit const&, KIM::ChargeUnit const&, KIM::TemperatureUnit const&, KIM::TimeUnit const&, std::__cxx11::basic_string, std::allocator > const&)#21}&&, pybind11::tuple (*)(KIM::Numbering const&, KIM::LengthUnit const&, KIM::EnergyUnit const&, KIM::ChargeUnit const&, KIM::TemperatureUnit const&, KIM::TimeUnit const&, std::__cxx11::basic_string, std::allocator > const&), pybind11::name const&, pybind11::scope const&, pybind11::sibling const&, char const (&) [115], pybind11::arg const&, char const (&) [115], char const (&) [115], char const (&) [115], char const (&) [115], char const (&) [115], char const (&) [115])::{lambda(pybind11::detail::function_call&)#3}::_FUN(pybind11::detail::function_call) (KIM_Model_bind.cpp:400) ==3256561== Address 0x14b0753d0 is 0 bytes inside a block of size 1,024 alloc'd ==3256561== at 0x483C583: operator new[](unsigned long) (in /usr/lib/x86_64-linux-gnu/valgrind/vgpreload_memcheck-amd64-linux.so) ==3256561== by 0x14BDC1D50: Spline::ProcessParameterFile(_IO_FILE*, int, bool) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BE7EA1A: MEAMSpline::ProcessPotentialFile(_IO_FILE*, int, std::vector, std::allocator >, std::allocator, std::allocator > > > const&) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD5EAE8: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD60C23: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD49DB7: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD4D59E: ModelDriverCreateRoutine (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14B5C5F1E: 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) ==3256561== by 0x14B5C6E18: 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) ==3256561== by 0x14B5CB762: 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) ==3256561== by 0x14B57B246: 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) ==3256561== by 0x14B4DB647: void pybind11::cpp_function::initialize, std::allocator > const&)#21}, pybind11::tuple, KIM::Numbering const&, KIM::LengthUnit const&, KIM::EnergyUnit const&, KIM::ChargeUnit const&, KIM::TemperatureUnit const&, KIM::TimeUnit const&, std::__cxx11::basic_string, std::allocator > const&, pybind11::name, pybind11::scope, pybind11::sibling, char [115], pybind11::arg, char [115], char [115], char [115], char [115], char [115], char [115]>(pybind11_init_model(pybind11::module_&)::{lambda(KIM::Numbering const&, KIM::LengthUnit const&, KIM::EnergyUnit const&, KIM::ChargeUnit const&, KIM::TemperatureUnit const&, KIM::TimeUnit const&, std::__cxx11::basic_string, std::allocator > const&)#21}&&, pybind11::tuple (*)(KIM::Numbering const&, KIM::LengthUnit const&, KIM::EnergyUnit const&, KIM::ChargeUnit const&, KIM::TemperatureUnit const&, KIM::TimeUnit const&, std::__cxx11::basic_string, std::allocator > const&), pybind11::name const&, pybind11::scope const&, pybind11::sibling const&, char const (&) [115], pybind11::arg const&, char const (&) [115], char const (&) [115], char const (&) [115], char const (&) [115], char const (&) [115], char const (&) [115])::{lambda(pybind11::detail::function_call&)#3}::_FUN(pybind11::detail::function_call) (KIM_Model_bind.cpp:400) ==3256561== ==3256561== Mismatched free() / delete / delete [] ==3256561== at 0x483CFBF: operator delete(void*) (in /usr/lib/x86_64-linux-gnu/valgrind/vgpreload_memcheck-amd64-linux.so) ==3256561== by 0x14BE7D2E1: MEAMSpline::ProcessPotentialFile(_IO_FILE*, int, std::vector, std::allocator >, std::allocator, std::allocator > > > const&) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD5EAE8: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD60C23: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD49DB7: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD4D59E: ModelDriverCreateRoutine (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14B5C5F1E: 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) ==3256561== by 0x14B5C6E18: 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) ==3256561== by 0x14B5CB762: 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) ==3256561== by 0x14B57B246: 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) ==3256561== by 0x14B4DB647: void pybind11::cpp_function::initialize, std::allocator > const&)#21}, pybind11::tuple, KIM::Numbering const&, KIM::LengthUnit const&, KIM::EnergyUnit const&, KIM::ChargeUnit const&, KIM::TemperatureUnit const&, KIM::TimeUnit const&, std::__cxx11::basic_string, std::allocator > const&, pybind11::name, pybind11::scope, pybind11::sibling, char [115], pybind11::arg, char [115], char [115], char [115], char [115], char [115], char [115]>(pybind11_init_model(pybind11::module_&)::{lambda(KIM::Numbering const&, KIM::LengthUnit const&, KIM::EnergyUnit const&, KIM::ChargeUnit const&, KIM::TemperatureUnit const&, KIM::TimeUnit const&, std::__cxx11::basic_string, std::allocator > const&)#21}&&, pybind11::tuple (*)(KIM::Numbering const&, KIM::LengthUnit const&, KIM::EnergyUnit const&, KIM::ChargeUnit const&, KIM::TemperatureUnit const&, KIM::TimeUnit const&, std::__cxx11::basic_string, std::allocator > const&), pybind11::name const&, pybind11::scope const&, pybind11::sibling const&, char const (&) [115], pybind11::arg const&, char const (&) [115], char const (&) [115], char const (&) [115], char const (&) [115], char const (&) [115], char const (&) [115])::{lambda(pybind11::detail::function_call&)#3}::_FUN(pybind11::detail::function_call) (KIM_Model_bind.cpp:400) ==3256561== by 0x14B4F114B: pybind11::cpp_function::dispatcher(_object*, _object*, _object*) (pybind11.h:939) ==3256561== Address 0x14b073790 is 0 bytes inside a block of size 1,024 alloc'd ==3256561== at 0x483C583: operator new[](unsigned long) (in /usr/lib/x86_64-linux-gnu/valgrind/vgpreload_memcheck-amd64-linux.so) ==3256561== by 0x14BE7CCC2: MEAMSpline::ProcessPotentialFile(_IO_FILE*, int, std::vector, std::allocator >, std::allocator, std::allocator > > > const&) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD5EAE8: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD60C23: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD49DB7: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14BD4D59E: ModelDriverCreateRoutine (in /mmfs1/scratch/bwaters2/bwaters/job-3d1c96ae-2f73-4dee-9585-c2b88a5a783e-007-cd3789bf-c2ad-4a82-a06e-bcb119c99bf2/VC_561022993723_004-and-MO_386038428339_000-1686075432/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==3256561== by 0x14B5C5F1E: 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) ==3256561== by 0x14B5C6E18: 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) ==3256561== by 0x14B5CB762: 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) ==3256561== by 0x14B57B246: 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) ==3256561== by 0x14B4DB647: void pybind11::cpp_function::initialize, std::allocator > const&)#21}, pybind11::tuple, KIM::Numbering const&, KIM::LengthUnit const&, KIM::EnergyUnit const&, KIM::ChargeUnit const&, KIM::TemperatureUnit const&, KIM::TimeUnit const&, std::__cxx11::basic_string, std::allocator > const&, pybind11::name, pybind11::scope, pybind11::sibling, char [115], pybind11::arg, char [115], char [115], char [115], char [115], char [115], char [115]>(pybind11_init_model(pybind11::module_&)::{lambda(KIM::Numbering const&, KIM::LengthUnit const&, KIM::EnergyUnit const&, KIM::ChargeUnit const&, KIM::TemperatureUnit const&, KIM::TimeUnit const&, std::__cxx11::basic_string, std::allocator > const&)#21}&&, pybind11::tuple (*)(KIM::Numbering const&, KIM::LengthUnit const&, KIM::EnergyUnit const&, KIM::ChargeUnit const&, KIM::TemperatureUnit const&, KIM::TimeUnit const&, std::__cxx11::basic_string, std::allocator > const&), pybind11::name const&, pybind11::scope const&, pybind11::sibling const&, char const (&) [115], pybind11::arg const&, char const (&) [115], char const (&) [115], char const (&) [115], char const (&) [115], char const (&) [115], char const (&) [115])::{lambda(pybind11::detail::function_call&)#3}::_FUN(pybind11::detail::function_call) (KIM_Model_bind.cpp:400) ==3256561== by 0x14B4F114B: pybind11::cpp_function::dispatcher(_object*, _object*, _object*) (pybind11.h:939) ==3256561== ==3256561== Conditional jump or move depends on uninitialised value(s) ==3256561== at 0x699E467: NpyIter_GetInnerFixedStrideArray (in /usr/local/lib/python3.8/dist-packages/numpy/core/_multiarray_umath.cpython-38-x86_64-linux-gnu.so) ==3256561== by 0x6A9AACC: execute_ufunc_loop (in /usr/local/lib/python3.8/dist-packages/numpy/core/_multiarray_umath.cpython-38-x86_64-linux-gnu.so) ==3256561== by 0x6AA3C47: ufunc_generic_fastcall (in /usr/local/lib/python3.8/dist-packages/numpy/core/_multiarray_umath.cpython-38-x86_64-linux-gnu.so) ==3256561== by 0x5F3C40: ??? (in /usr/bin/python3.8) ==3256561== by 0x5F3F04: PyObject_CallFunctionObjArgs (in /usr/bin/python3.8) ==3256561== by 0x69B0AA5: array_add (in /usr/local/lib/python3.8/dist-packages/numpy/core/_multiarray_umath.cpython-38-x86_64-linux-gnu.so) ==3256561== by 0x50F85E: PyNumber_Add (in /usr/bin/python3.8) ==3256561== by 0x56C1D8: _PyEval_EvalFrameDefault (in /usr/bin/python3.8) ==3256561== by 0x5F6835: _PyFunction_Vectorcall (in /usr/bin/python3.8) ==3256561== by 0x56BBDE: _PyEval_EvalFrameDefault (in /usr/bin/python3.8) ==3256561== by 0x569CE9: _PyEval_EvalCodeWithName (in /usr/bin/python3.8) ==3256561== by 0x5F6A12: _PyFunction_Vectorcall (in /usr/bin/python3.8) ==3256561== ==3256561== ==3256561== HEAP SUMMARY: ==3256561== in use at exit: 2,273,514 bytes in 1,705 blocks ==3256561== total heap usage: 59,728 allocs, 58,023 frees, 72,182,466 bytes allocated ==3256561== ==3256561== LEAK SUMMARY: ==3256561== definitely lost: 0 bytes in 0 blocks ==3256561== indirectly lost: 0 bytes in 0 blocks ==3256561== possibly lost: 188,754 bytes in 107 blocks ==3256561== still reachable: 2,084,728 bytes in 1,597 blocks ==3256561== of which reachable via heuristic: ==3256561== stdstring : 38 bytes in 1 blocks ==3256561== suppressed: 32 bytes in 1 blocks ==3256561== Rerun with --leak-check=full to see details of leaked memory ==3256561== ==3256561== Use --track-origins=yes to see where uninitialised values come from ==3256561== For lists of detected and suppressed errors, rerun with: -s ==3256561== ERROR SUMMARY: 31 errors from 7 contexts (suppressed: 17897 from 603) ================================================================================ 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.