!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! !!!!! !!!!! !!!!! 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_ParkFellingerLenosky_2012_W__MO_560940542741_002 Supported species : W random seed = 13 lattice constant (orig) = 3.000 perturbation amplitude = 0.300 number unit cells per side = 2 ----------------------------------------------------------------------------------------------------- MONOATOMIC STRUCTURE (pbc=False)-- Species = W (Configuration in file "config-F-W.xyz") ----------------------------------------------------------------------------------------------------- Energy = 112.15352687815383 Forces: 1 -7.48680033e+00 -6.84451475e+00 -1.20508197e+01 2 -1.88364390e+00 -3.23933764e+00 -3.52731083e+01 3 1.58934831e+00 -3.00951877e+01 3.91635984e+00 4 -2.81807774e+01 7.70788103e-01 5.53227303e+00 5 -4.61633747e+00 -1.98330138e+01 -1.77586014e+01 6 2.19930106e+01 2.21695955e+00 -2.17410421e+01 7 1.37655614e+01 -1.44353582e+01 9.95129668e+00 8 -1.08747029e+01 1.22517898e+00 9.03475361e+00 9 -1.25088901e+01 -2.99557164e+00 -1.97591485e+01 10 1.05877568e+01 1.95187871e+01 -8.38903961e+00 11 -1.35760000e+01 -1.05871256e+01 -4.81880664e+00 12 -2.36207950e+01 2.25814217e+01 5.14458216e+00 13 1.45475337e+01 -8.49650930e+00 -2.06904984e+01 14 2.28598832e+01 2.95166953e+01 -2.06265172e+01 15 1.35360575e+01 -3.48341625e+00 -1.25528260e+01 16 -4.19487501e+00 3.43461877e+01 1.43751030e+00 17 -2.53092840e+01 -1.71540635e+01 -7.83335514e+00 18 -3.34405687e-02 5.82397227e+00 -1.37622747e+00 19 7.38217262e+00 -2.32008798e+01 1.60460765e+01 20 -2.09741579e+01 1.16887236e+01 2.01524615e+01 21 -9.03670549e-01 -3.07158891e+01 3.94245360e+00 22 2.86713940e+01 5.31646444e+00 1.46205612e+00 23 8.47921756e+00 -9.23991174e+00 1.21275681e+01 24 5.28343972e+00 2.56200175e+00 2.25051425e+01 25 -1.63649708e+01 -6.94354207e+00 -8.02642760e+00 26 1.16509745e+01 2.64918256e+01 -6.78294978e+00 27 -2.05605399e+00 -6.71993733e+00 2.69444997e+01 28 -2.16081322e+01 1.08153450e+01 1.84828746e+01 29 1.69755302e+00 -1.62860062e+01 8.32908981e+00 30 2.12525053e+01 2.30174580e+01 3.04084730e+00 31 1.06957227e+01 -3.60813751e+00 1.05912848e+01 32 2.00401307e-01 1.79865931e+01 1.90382379e+01 MONOATOMIC STRUCTURE (pbc=True)-- Species = W (Configuration in file "config-T-W.xyz") ----------------------------------------------------------------------------------------------------- Energy = 112.15352687815383 Forces: 1 -7.48680033e+00 -6.84451475e+00 -1.20508197e+01 2 -1.88364390e+00 -3.23933764e+00 -3.52731083e+01 3 1.58934831e+00 -3.00951877e+01 3.91635984e+00 4 -2.81807774e+01 7.70788103e-01 5.53227303e+00 5 -4.61633747e+00 -1.98330138e+01 -1.77586014e+01 6 2.19930106e+01 2.21695955e+00 -2.17410421e+01 7 1.37655614e+01 -1.44353582e+01 9.95129668e+00 8 -1.08747029e+01 1.22517898e+00 9.03475361e+00 9 -1.25088901e+01 -2.99557164e+00 -1.97591485e+01 10 1.05877568e+01 1.95187871e+01 -8.38903961e+00 11 -1.35760000e+01 -1.05871256e+01 -4.81880664e+00 12 -2.36207950e+01 2.25814217e+01 5.14458216e+00 13 1.45475337e+01 -8.49650930e+00 -2.06904984e+01 14 2.28598832e+01 2.95166953e+01 -2.06265172e+01 15 1.35360575e+01 -3.48341625e+00 -1.25528260e+01 16 -4.19487501e+00 3.43461877e+01 1.43751030e+00 17 -2.53092840e+01 -1.71540635e+01 -7.83335514e+00 18 -3.34405687e-02 5.82397227e+00 -1.37622747e+00 19 7.38217262e+00 -2.32008798e+01 1.60460765e+01 20 -2.09741579e+01 1.16887236e+01 2.01524615e+01 21 -9.03670549e-01 -3.07158891e+01 3.94245360e+00 22 2.86713940e+01 5.31646444e+00 1.46205612e+00 23 8.47921756e+00 -9.23991174e+00 1.21275681e+01 24 5.28343972e+00 2.56200175e+00 2.25051425e+01 25 -1.63649708e+01 -6.94354207e+00 -8.02642760e+00 26 1.16509745e+01 2.64918256e+01 -6.78294978e+00 27 -2.05605399e+00 -6.71993733e+00 2.69444997e+01 28 -2.16081322e+01 1.08153450e+01 1.84828746e+01 29 1.69755302e+00 -1.62860062e+01 8.32908981e+00 30 2.12525053e+01 2.30174580e+01 3.04084730e+00 31 1.06957227e+01 -3.60813751e+00 1.05912848e+01 32 2.00401307e-01 1.79865931e+01 1.90382379e+01 ================================================================================ VALGRIND OUTPUT ================================================================================ ==2147757== Memcheck, a memory error detector ==2147757== Copyright (C) 2002-2017, and GNU GPL'd, by Julian Seward et al. ==2147757== Using Valgrind-3.15.0 and LibVEX; rerun with -h for copyright info ==2147757== Command: python runner2.py MEAM_LAMMPS_ParkFellingerLenosky_2012_W__MO_560940542741_002 ==2147757== ==2147757== Mismatched free() / delete / delete [] ==2147757== at 0x483CFBF: operator delete(void*) (in /usr/lib/x86_64-linux-gnu/valgrind/vgpreload_memcheck-amd64-linux.so) ==2147757== by 0x14BDC916F: Spline::ProcessParameterFile(_IO_FILE*, int, bool) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BE84074: MEAMSpline::ProcessPotentialFile(_IO_FILE*, int, std::vector, std::allocator >, std::allocator, std::allocator > > > const&) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD65AE8: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD67C23: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD50DB7: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD5459E: ModelDriverCreateRoutine (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== 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) ==2147757== 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) ==2147757== 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) ==2147757== 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) ==2147757== 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) ==2147757== Address 0x14b074340 is 0 bytes inside a block of size 1,024 alloc'd ==2147757== at 0x483C583: operator new[](unsigned long) (in /usr/lib/x86_64-linux-gnu/valgrind/vgpreload_memcheck-amd64-linux.so) ==2147757== by 0x14BDC8D50: Spline::ProcessParameterFile(_IO_FILE*, int, bool) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BE84074: MEAMSpline::ProcessPotentialFile(_IO_FILE*, int, std::vector, std::allocator >, std::allocator, std::allocator > > > const&) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD65AE8: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD67C23: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD50DB7: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD5459E: ModelDriverCreateRoutine (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== 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) ==2147757== 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) ==2147757== 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) ==2147757== 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) ==2147757== 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) ==2147757== ==2147757== Mismatched free() / delete / delete [] ==2147757== at 0x483CFBF: operator delete(void*) (in /usr/lib/x86_64-linux-gnu/valgrind/vgpreload_memcheck-amd64-linux.so) ==2147757== by 0x14BDC916F: Spline::ProcessParameterFile(_IO_FILE*, int, bool) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BE85328: MEAMSpline::ProcessPotentialFile(_IO_FILE*, int, std::vector, std::allocator >, std::allocator, std::allocator > > > const&) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD65AE8: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD67C23: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD50DB7: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD5459E: ModelDriverCreateRoutine (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== 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) ==2147757== 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) ==2147757== 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) ==2147757== 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) ==2147757== 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) ==2147757== Address 0x14b074af0 is 0 bytes inside a block of size 1,024 alloc'd ==2147757== at 0x483C583: operator new[](unsigned long) (in /usr/lib/x86_64-linux-gnu/valgrind/vgpreload_memcheck-amd64-linux.so) ==2147757== by 0x14BDC8D50: Spline::ProcessParameterFile(_IO_FILE*, int, bool) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BE85328: MEAMSpline::ProcessPotentialFile(_IO_FILE*, int, std::vector, std::allocator >, std::allocator, std::allocator > > > const&) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD65AE8: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD67C23: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD50DB7: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD5459E: ModelDriverCreateRoutine (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== 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) ==2147757== 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) ==2147757== 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) ==2147757== 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) ==2147757== 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) ==2147757== ==2147757== Mismatched free() / delete / delete [] ==2147757== at 0x483CFBF: operator delete(void*) (in /usr/lib/x86_64-linux-gnu/valgrind/vgpreload_memcheck-amd64-linux.so) ==2147757== by 0x14BDC916F: Spline::ProcessParameterFile(_IO_FILE*, int, bool) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BE8549C: MEAMSpline::ProcessPotentialFile(_IO_FILE*, int, std::vector, std::allocator >, std::allocator, std::allocator > > > const&) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD65AE8: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD67C23: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD50DB7: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD5459E: ModelDriverCreateRoutine (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== 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) ==2147757== 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) ==2147757== 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) ==2147757== 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) ==2147757== 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) ==2147757== Address 0x14b074f30 is 0 bytes inside a block of size 1,024 alloc'd ==2147757== at 0x483C583: operator new[](unsigned long) (in /usr/lib/x86_64-linux-gnu/valgrind/vgpreload_memcheck-amd64-linux.so) ==2147757== by 0x14BDC8D50: Spline::ProcessParameterFile(_IO_FILE*, int, bool) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BE8549C: MEAMSpline::ProcessPotentialFile(_IO_FILE*, int, std::vector, std::allocator >, std::allocator, std::allocator > > > const&) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD65AE8: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD67C23: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD50DB7: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD5459E: ModelDriverCreateRoutine (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== 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) ==2147757== 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) ==2147757== 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) ==2147757== 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) ==2147757== 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) ==2147757== ==2147757== Mismatched free() / delete / delete [] ==2147757== at 0x483CFBF: operator delete(void*) (in /usr/lib/x86_64-linux-gnu/valgrind/vgpreload_memcheck-amd64-linux.so) ==2147757== by 0x14BDC916F: Spline::ProcessParameterFile(_IO_FILE*, int, bool) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BE8572B: MEAMSpline::ProcessPotentialFile(_IO_FILE*, int, std::vector, std::allocator >, std::allocator, std::allocator > > > const&) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD65AE8: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD67C23: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD50DB7: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD5459E: ModelDriverCreateRoutine (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== 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) ==2147757== 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) ==2147757== 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) ==2147757== 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) ==2147757== 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) ==2147757== Address 0x4e1aa80 is 0 bytes inside a block of size 1,024 alloc'd ==2147757== at 0x483C583: operator new[](unsigned long) (in /usr/lib/x86_64-linux-gnu/valgrind/vgpreload_memcheck-amd64-linux.so) ==2147757== by 0x14BDC8D50: Spline::ProcessParameterFile(_IO_FILE*, int, bool) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BE8572B: MEAMSpline::ProcessPotentialFile(_IO_FILE*, int, std::vector, std::allocator >, std::allocator, std::allocator > > > const&) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD65AE8: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD67C23: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD50DB7: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD5459E: ModelDriverCreateRoutine (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== 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) ==2147757== 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) ==2147757== 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) ==2147757== 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) ==2147757== 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) ==2147757== ==2147757== Mismatched free() / delete / delete [] ==2147757== at 0x483CFBF: operator delete(void*) (in /usr/lib/x86_64-linux-gnu/valgrind/vgpreload_memcheck-amd64-linux.so) ==2147757== by 0x14BDC916F: Spline::ProcessParameterFile(_IO_FILE*, int, bool) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BE85A1A: MEAMSpline::ProcessPotentialFile(_IO_FILE*, int, std::vector, std::allocator >, std::allocator, std::allocator > > > const&) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD65AE8: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD67C23: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD50DB7: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD5459E: ModelDriverCreateRoutine (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== 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) ==2147757== 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) ==2147757== 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) ==2147757== 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) ==2147757== 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) ==2147757== Address 0x14b075370 is 0 bytes inside a block of size 1,024 alloc'd ==2147757== at 0x483C583: operator new[](unsigned long) (in /usr/lib/x86_64-linux-gnu/valgrind/vgpreload_memcheck-amd64-linux.so) ==2147757== by 0x14BDC8D50: Spline::ProcessParameterFile(_IO_FILE*, int, bool) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BE85A1A: MEAMSpline::ProcessPotentialFile(_IO_FILE*, int, std::vector, std::allocator >, std::allocator, std::allocator > > > const&) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD65AE8: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD67C23: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD50DB7: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD5459E: ModelDriverCreateRoutine (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== 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) ==2147757== 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) ==2147757== 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) ==2147757== 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) ==2147757== 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) ==2147757== ==2147757== Mismatched free() / delete / delete [] ==2147757== at 0x483CFBF: operator delete(void*) (in /usr/lib/x86_64-linux-gnu/valgrind/vgpreload_memcheck-amd64-linux.so) ==2147757== by 0x14BE842E1: MEAMSpline::ProcessPotentialFile(_IO_FILE*, int, std::vector, std::allocator >, std::allocator, std::allocator > > > const&) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD65AE8: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD67C23: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD50DB7: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD5459E: ModelDriverCreateRoutine (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== 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) ==2147757== 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) ==2147757== 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) ==2147757== 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) ==2147757== 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) ==2147757== by 0x14B4F114B: pybind11::cpp_function::dispatcher(_object*, _object*, _object*) (pybind11.h:939) ==2147757== Address 0x14b0738d0 is 0 bytes inside a block of size 1,024 alloc'd ==2147757== at 0x483C583: operator new[](unsigned long) (in /usr/lib/x86_64-linux-gnu/valgrind/vgpreload_memcheck-amd64-linux.so) ==2147757== by 0x14BE83CC2: MEAMSpline::ProcessPotentialFile(_IO_FILE*, int, std::vector, std::allocator >, std::allocator, std::allocator > > > const&) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD65AE8: MEAMImplementation::ProcessParameterFiles(KIM::ModelDriverCreate*, int, _IO_FILE* const*) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD67C23: MEAMImplementation::MEAMImplementation(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD50DB7: MEAM::MEAM(KIM::ModelDriverCreate*, KIM::LengthUnit, KIM::EnergyUnit, KIM::ChargeUnit, KIM::TemperatureUnit, KIM::TimeUnit, int*) (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== by 0x14BD5459E: ModelDriverCreateRoutine (in /mmfs1/scratch/bwaters2/bwaters/job-86883a65-5eef-4ac2-a1f8-5e33f21cbb18-007-ff04a014-860b-4784-adb3-3e95c4da375c/VC_561022993723_004-and-MO_560940542741_002-1683681527/staged_job_files/repository/md/MEAM_LAMMPS__MD_249792265679_002/libkim-api-model-driver.so) ==2147757== 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) ==2147757== 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) ==2147757== 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) ==2147757== 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) ==2147757== 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) ==2147757== by 0x14B4F114B: pybind11::cpp_function::dispatcher(_object*, _object*, _object*) (pybind11.h:939) ==2147757== ==2147757== Conditional jump or move depends on uninitialised value(s) ==2147757== at 0x699E467: NpyIter_GetInnerFixedStrideArray (in /usr/local/lib/python3.8/dist-packages/numpy/core/_multiarray_umath.cpython-38-x86_64-linux-gnu.so) ==2147757== by 0x6A9AACC: execute_ufunc_loop (in /usr/local/lib/python3.8/dist-packages/numpy/core/_multiarray_umath.cpython-38-x86_64-linux-gnu.so) ==2147757== by 0x6AA3C47: ufunc_generic_fastcall (in /usr/local/lib/python3.8/dist-packages/numpy/core/_multiarray_umath.cpython-38-x86_64-linux-gnu.so) ==2147757== by 0x5F3C40: ??? (in /usr/bin/python3.8) ==2147757== by 0x5F3F04: PyObject_CallFunctionObjArgs (in /usr/bin/python3.8) ==2147757== by 0x69B0AA5: array_add (in /usr/local/lib/python3.8/dist-packages/numpy/core/_multiarray_umath.cpython-38-x86_64-linux-gnu.so) ==2147757== by 0x50F85E: PyNumber_Add (in /usr/bin/python3.8) ==2147757== by 0x56C1D8: _PyEval_EvalFrameDefault (in /usr/bin/python3.8) ==2147757== by 0x5F6835: _PyFunction_Vectorcall (in /usr/bin/python3.8) ==2147757== by 0x56BBDE: _PyEval_EvalFrameDefault (in /usr/bin/python3.8) ==2147757== by 0x569CE9: _PyEval_EvalCodeWithName (in /usr/bin/python3.8) ==2147757== by 0x5F6A12: _PyFunction_Vectorcall (in /usr/bin/python3.8) ==2147757== ==2147757== ==2147757== HEAP SUMMARY: ==2147757== in use at exit: 2,273,514 bytes in 1,705 blocks ==2147757== total heap usage: 59,756 allocs, 58,051 frees, 72,189,953 bytes allocated ==2147757== ==2147757== LEAK SUMMARY: ==2147757== definitely lost: 0 bytes in 0 blocks ==2147757== indirectly lost: 0 bytes in 0 blocks ==2147757== possibly lost: 188,754 bytes in 107 blocks ==2147757== still reachable: 2,084,728 bytes in 1,597 blocks ==2147757== of which reachable via heuristic: ==2147757== stdstring : 38 bytes in 1 blocks ==2147757== suppressed: 32 bytes in 1 blocks ==2147757== Rerun with --leak-check=full to see details of leaked memory ==2147757== ==2147757== Use --track-origins=yes to see where uninitialised values come from ==2147757== For lists of detected and suppressed errors, rerun with: -s ==2147757== ERROR SUMMARY: 31 errors from 7 contexts (suppressed: 17978 from 651) ================================================================================ 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.