!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! !!!!! !!!!! !!!!! 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_YangQi_2019_Nb__MO_360068930164_002 Supported species : Nb random seed = 13 lattice constant (orig) = 3.000 perturbation amplitude = 0.300 number unit cells per side = 2 ----------------------------------------------------------------------------------------------------- MONOATOMIC STRUCTURE (pbc=False)-- Species = Nb (Configuration in file "config-F-Nb.xyz") ----------------------------------------------------------------------------------------------------- Energy = 468.5017542446021 Forces: 1 -5.13687693e+01 -3.75960587e+01 -2.95991396e+01 2 -1.67212238e+00 -2.23299200e+01 -5.90404299e+01 3 1.51164263e+01 -5.12893109e+01 1.56326167e+01 4 -4.85974726e+01 7.30642851e+00 3.37956956e+00 5 -4.70081783e+00 -5.05931901e+01 -5.23658668e+01 6 3.10713673e+01 1.01015771e+01 -5.27046492e+01 7 7.31613819e+01 -8.63123763e+01 -3.57197794e+00 8 1.51882758e+00 -2.23470286e+01 -1.45727412e+01 9 -4.37719055e+01 -8.95115010e+00 -6.88348503e+01 10 -2.05978360e+01 9.56528788e+01 -9.09428114e+01 11 -2.78341288e+01 -2.71335250e+01 -2.05396401e+01 12 -6.00265900e+01 4.65389999e+01 6.50877941e+00 13 -3.22594318e+00 2.42304572e-01 -1.11561232e+02 14 3.64054558e+01 4.17411523e+01 -2.66293037e+01 15 1.32167669e+02 -3.62879469e+01 -4.91136114e+01 16 2.12123974e+01 1.16532751e+02 -3.91910451e+01 17 -5.50092968e+01 -2.26918338e+01 -1.23087940e+01 18 -3.77238377e+01 -3.25780273e+00 4.11367679e+01 19 9.21297271e+00 -6.12589257e+01 2.44564922e+01 20 -3.42187571e+01 9.31181442e+00 2.82098075e+01 21 -9.19300946e+00 -6.13079204e+01 3.16405073e+01 22 6.05269559e+01 2.32568099e+00 2.25668156e+01 23 2.84950732e+01 -1.86140668e+01 2.79422373e+01 24 -2.01212048e+00 1.52876129e+01 4.89429343e+01 25 -1.10772432e+02 -3.59770590e+01 2.90719107e+00 26 -4.44994245e+01 1.26059274e+02 3.18404646e+01 27 -1.75405647e+01 -4.11426625e+01 7.65656935e+01 28 -2.40786407e+01 3.45920711e+01 2.53753949e+01 29 3.35722515e+01 -4.49854200e+01 7.29666261e+01 30 5.42914403e+01 1.04934881e+02 2.15182878e+01 31 7.37676876e+01 -4.36605927e+01 7.94232522e+01 32 2.63237627e+01 6.51093630e+01 6.99626547e+01 MONOATOMIC STRUCTURE (pbc=True)-- Species = Nb (Configuration in file "config-T-Nb.xyz") ----------------------------------------------------------------------------------------------------- Energy = 468.5017542446021 Forces: 1 -5.13687693e+01 -3.75960587e+01 -2.95991396e+01 2 -1.67212238e+00 -2.23299200e+01 -5.90404299e+01 3 1.51164263e+01 -5.12893109e+01 1.56326167e+01 4 -4.85974726e+01 7.30642851e+00 3.37956956e+00 5 -4.70081783e+00 -5.05931901e+01 -5.23658668e+01 6 3.10713673e+01 1.01015771e+01 -5.27046492e+01 7 7.31613819e+01 -8.63123763e+01 -3.57197794e+00 8 1.51882758e+00 -2.23470286e+01 -1.45727412e+01 9 -4.37719055e+01 -8.95115010e+00 -6.88348503e+01 10 -2.05978360e+01 9.56528788e+01 -9.09428114e+01 11 -2.78341288e+01 -2.71335250e+01 -2.05396401e+01 12 -6.00265900e+01 4.65389999e+01 6.50877941e+00 13 -3.22594318e+00 2.42304572e-01 -1.11561232e+02 14 3.64054558e+01 4.17411523e+01 -2.66293037e+01 15 1.32167669e+02 -3.62879469e+01 -4.91136114e+01 16 2.12123974e+01 1.16532751e+02 -3.91910451e+01 17 -5.50092968e+01 -2.26918338e+01 -1.23087940e+01 18 -3.77238377e+01 -3.25780273e+00 4.11367679e+01 19 9.21297271e+00 -6.12589257e+01 2.44564922e+01 20 -3.42187571e+01 9.31181442e+00 2.82098075e+01 21 -9.19300946e+00 -6.13079204e+01 3.16405073e+01 22 6.05269559e+01 2.32568099e+00 2.25668156e+01 23 2.84950732e+01 -1.86140668e+01 2.79422373e+01 24 -2.01212048e+00 1.52876129e+01 4.89429343e+01 25 -1.10772432e+02 -3.59770590e+01 2.90719107e+00 26 -4.44994245e+01 1.26059274e+02 3.18404646e+01 27 -1.75405647e+01 -4.11426625e+01 7.65656935e+01 28 -2.40786407e+01 3.45920711e+01 2.53753949e+01 29 3.35722515e+01 -4.49854200e+01 7.29666261e+01 30 5.42914403e+01 1.04934881e+02 2.15182878e+01 31 7.37676876e+01 -4.36605927e+01 7.94232522e+01 32 2.63237627e+01 6.51093630e+01 6.99626547e+01 ================================================================================ VALGRIND OUTPUT ================================================================================ ==2226369== Memcheck, a memory error detector ==2226369== Copyright (C) 2002-2017, and GNU GPL'd, by Julian Seward et al. ==2226369== Using Valgrind-3.15.0 and LibVEX; rerun with -h for copyright info ==2226369== Command: python runner2.py MEAM_LAMMPS_YangQi_2019_Nb__MO_360068930164_002 ==2226369== ==2226369== Mismatched free() / delete / delete [] ==2226369== at 0x483CFBF: operator delete(void*) (in /usr/lib/x86_64-linux-gnu/valgrind/vgpreload_memcheck-amd64-linux.so) ==2226369== by 0x14BDC916F: Spline::ProcessParameterFile(_IO_FILE*, int, bool) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BE84074: MEAMSpline::ProcessPotentialFile(_IO_FILE*, int, std::vector, std::allocator >, std::allocator, std::allocator > > > const&) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD65AE8: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD67C23: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD50DB7: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD5459E: ModelDriverCreateRoutine (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== 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) ==2226369== 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) ==2226369== 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) ==2226369== 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) ==2226369== 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) ==2226369== Address 0x14b074190 is 0 bytes inside a block of size 1,024 alloc'd ==2226369== at 0x483C583: operator new[](unsigned long) (in /usr/lib/x86_64-linux-gnu/valgrind/vgpreload_memcheck-amd64-linux.so) ==2226369== by 0x14BDC8D50: Spline::ProcessParameterFile(_IO_FILE*, int, bool) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BE84074: MEAMSpline::ProcessPotentialFile(_IO_FILE*, int, std::vector, std::allocator >, std::allocator, std::allocator > > > const&) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD65AE8: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD67C23: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD50DB7: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD5459E: ModelDriverCreateRoutine (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== 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) ==2226369== 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) ==2226369== 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) ==2226369== 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) ==2226369== 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) ==2226369== ==2226369== Mismatched free() / delete / delete [] ==2226369== at 0x483CFBF: operator delete(void*) (in /usr/lib/x86_64-linux-gnu/valgrind/vgpreload_memcheck-amd64-linux.so) ==2226369== by 0x14BDC916F: Spline::ProcessParameterFile(_IO_FILE*, int, bool) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BE85328: MEAMSpline::ProcessPotentialFile(_IO_FILE*, int, std::vector, std::allocator >, std::allocator, std::allocator > > > const&) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD65AE8: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD67C23: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD50DB7: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD5459E: ModelDriverCreateRoutine (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== 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) ==2226369== 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) ==2226369== 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) ==2226369== 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) ==2226369== 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) ==2226369== Address 0x14b0748f0 is 0 bytes inside a block of size 1,024 alloc'd ==2226369== at 0x483C583: operator new[](unsigned long) (in /usr/lib/x86_64-linux-gnu/valgrind/vgpreload_memcheck-amd64-linux.so) ==2226369== by 0x14BDC8D50: Spline::ProcessParameterFile(_IO_FILE*, int, bool) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BE85328: MEAMSpline::ProcessPotentialFile(_IO_FILE*, int, std::vector, std::allocator >, std::allocator, std::allocator > > > const&) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD65AE8: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD67C23: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD50DB7: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD5459E: ModelDriverCreateRoutine (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== 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) ==2226369== 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) ==2226369== 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) ==2226369== 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) ==2226369== 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) ==2226369== ==2226369== Mismatched free() / delete / delete [] ==2226369== at 0x483CFBF: operator delete(void*) (in /usr/lib/x86_64-linux-gnu/valgrind/vgpreload_memcheck-amd64-linux.so) ==2226369== by 0x14BDC916F: Spline::ProcessParameterFile(_IO_FILE*, int, bool) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BE8549C: MEAMSpline::ProcessPotentialFile(_IO_FILE*, int, std::vector, std::allocator >, std::allocator, std::allocator > > > const&) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD65AE8: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD67C23: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD50DB7: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD5459E: ModelDriverCreateRoutine (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== 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) ==2226369== 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) ==2226369== 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) ==2226369== 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) ==2226369== 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) ==2226369== Address 0x14b074d30 is 0 bytes inside a block of size 1,024 alloc'd ==2226369== at 0x483C583: operator new[](unsigned long) (in /usr/lib/x86_64-linux-gnu/valgrind/vgpreload_memcheck-amd64-linux.so) ==2226369== by 0x14BDC8D50: Spline::ProcessParameterFile(_IO_FILE*, int, bool) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BE8549C: MEAMSpline::ProcessPotentialFile(_IO_FILE*, int, std::vector, std::allocator >, std::allocator, std::allocator > > > const&) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD65AE8: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD67C23: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD50DB7: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD5459E: ModelDriverCreateRoutine (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== 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) ==2226369== 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) ==2226369== 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) ==2226369== 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) ==2226369== 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) ==2226369== ==2226369== Mismatched free() / delete / delete [] ==2226369== at 0x483CFBF: operator delete(void*) (in /usr/lib/x86_64-linux-gnu/valgrind/vgpreload_memcheck-amd64-linux.so) ==2226369== by 0x14BDC916F: Spline::ProcessParameterFile(_IO_FILE*, int, bool) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BE8572B: MEAMSpline::ProcessPotentialFile(_IO_FILE*, int, std::vector, std::allocator >, std::allocator, std::allocator > > > const&) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD65AE8: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD67C23: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD50DB7: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD5459E: ModelDriverCreateRoutine (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== 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) ==2226369== 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) ==2226369== 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) ==2226369== 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) ==2226369== 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) ==2226369== Address 0x4e1a3e0 is 0 bytes inside a block of size 1,024 alloc'd ==2226369== at 0x483C583: operator new[](unsigned long) (in /usr/lib/x86_64-linux-gnu/valgrind/vgpreload_memcheck-amd64-linux.so) ==2226369== by 0x14BDC8D50: Spline::ProcessParameterFile(_IO_FILE*, int, bool) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BE8572B: MEAMSpline::ProcessPotentialFile(_IO_FILE*, int, std::vector, std::allocator >, std::allocator, std::allocator > > > const&) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD65AE8: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD67C23: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD50DB7: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD5459E: ModelDriverCreateRoutine (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== 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) ==2226369== 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) ==2226369== 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) ==2226369== 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) ==2226369== 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) ==2226369== ==2226369== Mismatched free() / delete / delete [] ==2226369== at 0x483CFBF: operator delete(void*) (in /usr/lib/x86_64-linux-gnu/valgrind/vgpreload_memcheck-amd64-linux.so) ==2226369== by 0x14BDC916F: Spline::ProcessParameterFile(_IO_FILE*, int, bool) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BE85A1A: MEAMSpline::ProcessPotentialFile(_IO_FILE*, int, std::vector, std::allocator >, std::allocator, std::allocator > > > const&) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD65AE8: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD67C23: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD50DB7: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD5459E: ModelDriverCreateRoutine (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== 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) ==2226369== 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) ==2226369== 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) ==2226369== 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) ==2226369== 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) ==2226369== Address 0x14b075170 is 0 bytes inside a block of size 1,024 alloc'd ==2226369== at 0x483C583: operator new[](unsigned long) (in /usr/lib/x86_64-linux-gnu/valgrind/vgpreload_memcheck-amd64-linux.so) ==2226369== by 0x14BDC8D50: Spline::ProcessParameterFile(_IO_FILE*, int, bool) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BE85A1A: MEAMSpline::ProcessPotentialFile(_IO_FILE*, int, std::vector, std::allocator >, std::allocator, std::allocator > > > const&) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD65AE8: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD67C23: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD50DB7: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD5459E: ModelDriverCreateRoutine (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== 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) ==2226369== 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) ==2226369== 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) ==2226369== 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) ==2226369== 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) ==2226369== ==2226369== Mismatched free() / delete / delete [] ==2226369== at 0x483CFBF: operator delete(void*) (in /usr/lib/x86_64-linux-gnu/valgrind/vgpreload_memcheck-amd64-linux.so) ==2226369== by 0x14BE842E1: MEAMSpline::ProcessPotentialFile(_IO_FILE*, int, std::vector, std::allocator >, std::allocator, std::allocator > > > const&) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD65AE8: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD67C23: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD50DB7: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD5459E: ModelDriverCreateRoutine (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== 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) ==2226369== 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) ==2226369== 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) ==2226369== 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) ==2226369== 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) ==2226369== by 0x14B4F114B: pybind11::cpp_function::dispatcher(_object*, _object*, _object*) (pybind11.h:939) ==2226369== Address 0x14b073720 is 0 bytes inside a block of size 1,024 alloc'd ==2226369== at 0x483C583: operator new[](unsigned long) (in /usr/lib/x86_64-linux-gnu/valgrind/vgpreload_memcheck-amd64-linux.so) ==2226369== by 0x14BE83CC2: MEAMSpline::ProcessPotentialFile(_IO_FILE*, int, std::vector, std::allocator >, std::allocator, std::allocator > > > const&) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD65AE8: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD67C23: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD50DB7: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== by 0x14BD5459E: ModelDriverCreateRoutine (in /mmfs1/scratch/bwaters2/bwaters/job-69c95e82-65cf-4e08-8514-88bc0fe164de-007-a2f2a83c-cbc5-47da-bac4-7699950cac23/VC_561022993723_004-and-MO_360068930164_002-1683685798/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2226369== 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) ==2226369== 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) ==2226369== 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) ==2226369== 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) ==2226369== 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) ==2226369== by 0x14B4F114B: pybind11::cpp_function::dispatcher(_object*, _object*, _object*) (pybind11.h:939) ==2226369== ==2226369== Conditional jump or move depends on uninitialised value(s) ==2226369== at 0x699E467: NpyIter_GetInnerFixedStrideArray (in /usr/local/lib/python3.8/dist-packages/numpy/core/_multiarray_umath.cpython-38-x86_64-linux-gnu.so) ==2226369== by 0x6A9AACC: execute_ufunc_loop (in /usr/local/lib/python3.8/dist-packages/numpy/core/_multiarray_umath.cpython-38-x86_64-linux-gnu.so) ==2226369== by 0x6AA3C47: ufunc_generic_fastcall (in /usr/local/lib/python3.8/dist-packages/numpy/core/_multiarray_umath.cpython-38-x86_64-linux-gnu.so) ==2226369== by 0x5F3C40: ??? (in /usr/bin/python3.8) ==2226369== by 0x5F3F04: PyObject_CallFunctionObjArgs (in /usr/bin/python3.8) ==2226369== by 0x69B0AA5: array_add (in /usr/local/lib/python3.8/dist-packages/numpy/core/_multiarray_umath.cpython-38-x86_64-linux-gnu.so) ==2226369== by 0x50F85E: PyNumber_Add (in /usr/bin/python3.8) ==2226369== by 0x56C1D8: _PyEval_EvalFrameDefault (in /usr/bin/python3.8) ==2226369== by 0x5F6835: _PyFunction_Vectorcall (in /usr/bin/python3.8) ==2226369== by 0x56BBDE: _PyEval_EvalFrameDefault (in /usr/bin/python3.8) ==2226369== by 0x569CE9: _PyEval_EvalCodeWithName (in /usr/bin/python3.8) ==2226369== by 0x5F6A12: _PyFunction_Vectorcall (in /usr/bin/python3.8) ==2226369== ==2226369== ==2226369== HEAP SUMMARY: ==2226369== in use at exit: 2,273,514 bytes in 1,705 blocks ==2226369== total heap usage: 59,728 allocs, 58,023 frees, 72,182,385 bytes allocated ==2226369== ==2226369== LEAK SUMMARY: ==2226369== definitely lost: 0 bytes in 0 blocks ==2226369== indirectly lost: 0 bytes in 0 blocks ==2226369== possibly lost: 188,754 bytes in 107 blocks ==2226369== still reachable: 2,084,728 bytes in 1,597 blocks ==2226369== of which reachable via heuristic: ==2226369== stdstring : 38 bytes in 1 blocks ==2226369== suppressed: 32 bytes in 1 blocks ==2226369== Rerun with --leak-check=full to see details of leaked memory ==2226369== ==2226369== Use --track-origins=yes to see where uninitialised values come from ==2226369== For lists of detected and suppressed errors, rerun with: -s ==2226369== ERROR SUMMARY: 31 errors from 7 contexts (suppressed: 17966 from 602) ================================================================================ 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.