RuntimeError: Job process returned error code 1 Traceback (most recent call last): File "/usr/local/bin/run_openkim_job.py", line 546, in execute_in_place(runner, runner_driver, subject, subject_driver, env) File "/usr/local/bin/run_openkim_job.py", line 396, in execute_in_place raise RuntimeError(f"Job process returned error code {retcode}") RuntimeError: Job process returned error code 1 output/pipeline.stdout: ----------------------- representative atom coordinates = [[0 0 0]]spacegroup = 221cell = [[1.774, 0, 0], [0, 1.774, 0], [0, 0, 1.774]]========================================= Step Time Energy fmaxBFGS: 0 14:14:31 -4.738416 9.7547BFGS: 1 14:14:31 -4.101996 1.4103BFGS: 2 14:14:31 -4.125212 1.2399BFGS: 3 14:14:31 -4.671464 9.8416BFGS: 4 14:14:31 -4.163870 5.3785BFGS: 5 14:14:31 -4.679851 4.5054BFGS: 6 14:14:31 -3.926796 11.0679BFGS: 7 14:14:31 -4.898447 6.8597BFGS: 8 14:14:31 -4.622024 9.9424BFGS: 9 14:14:31 -4.860366 10.1770BFGS: 10 14:14:31 -4.082400 1.7781BFGS: 11 14:14:31 -4.114810 1.1720BFGS: 12 14:14:32 -4.477977 26.8254BFGS: 13 14:14:32 -4.776722 4.7402BFGS: 14 14:14:32 -4.823141 4.9186 output/pipeline.stderr: ----------------------- File "../../td/EquilibriumCrystalStructure__TD_457028483760_001/runner", line 142, in forces = atoms.get_forces() File "/usr/local/lib/python3.8/dist-packages/ase/atoms.py", line 788, in get_forces forces = self._calc.get_forces(self) File "/usr/local/lib/python3.8/dist-packages/ase/calculators/abc.py", line 23, in get_forces return self.get_property('forces', atoms) File "/usr/local/lib/python3.8/dist-packages/ase/calculators/calculator.py", line 737, in get_property self.calculate(atoms, [name], system_changes) File "/usr/local/lib/python3.8/dist-packages/ase/calculators/lammpslib.py", line 356, in calculate self.propagate(atoms, properties, system_changes, 0) File "/usr/local/lib/python3.8/dist-packages/ase/calculators/lammpslib.py", line 462, in propagate self.lmp.command('run %d' % n_steps) File "/usr/local/lib/python3.8/dist-packages/lammps/core.py", line 581, in command self.lib.lammps_command(self.lmp,cmd) File "/usr/local/lib/python3.8/dist-packages/lammps/core.py", line 49, in __exit__ raise self.lmp._lammps_exceptionException: ERROR: Too many ghost atoms (src/REAXFF/pair_reaxff.cpp:549)Command exited with non-zero status 1{"realtime":4.70,"usertime":7.29,"systime":23.13,"memmax":185144,"memavg":0} output/kim.log: --------------- 2023-09-26:14:14:30MDT * 0 * information * 0x2420c50 * KIM_LogImplementation.cpp:107 * Log object created. Default verbosity level is 'information'.2023-09-26:14:14:30MDT * 1 * information * 0x2420c50 * KIM_LogImplementation.cpp:242 * Log object renamed. ID changed to '0_Collections'.2023-09-26:14:14:30MDT * 2 * information * 0_Collections * KIM_LogImplementation.cpp:246 * Log object renamed. ID changed from '0x2420c50'.2023-09-26:14:14:30MDT * 3 * information * 0_Collections * KIM_LogImplementation.cpp:119 * Log object destroyed.2023-09-26:14:14:30MDT * 0 * information * 0x2420c50 * KIM_LogImplementation.cpp:107 * Log object created. Default verbosity level is 'information'.2023-09-26:14:14:30MDT * 0 * information * 0x2423d00 * KIM_LogImplementation.cpp:107 * Log object created. Default verbosity level is 'information'.2023-09-26:14:14:30MDT * 1 * information * 0x2423d00 * KIM_LogImplementation.cpp:242 * Log object renamed. ID changed to '0x2420c50_Collections'.2023-09-26:14:14:30MDT * 2 * information * 0x2420c50_Collections * KIM_LogImplementation.cpp:246 * Log object renamed. ID changed from '0x2423d00'.2023-09-26:14:14:30MDT * 3 * information * 0x2420c50_Collections * KIM_LogImplementation.cpp:119 * Log object destroyed.2023-09-26:14:14:30MDT * 1 * information * 0x2420c50 * KIM_LogImplementation.cpp:242 * Log object renamed. ID changed to '0_SimulatorModel'.2023-09-26:14:14:30MDT * 2 * information * 0_SimulatorModel * KIM_LogImplementation.cpp:246 * Log object renamed. ID changed from '0x2420c50'.2023-09-26:14:14:30MDT * 3 * information * 0_SimulatorModel * KIM_LogImplementation.cpp:119 * Log object destroyed.2023-09-26:14:14:30MDT * 0 * information * 0x2420c50 * KIM_LogImplementation.cpp:107 * Log object created. Default verbosity level is 'information'.2023-09-26:14:14:30MDT * 0 * information * 0x24210c0 * KIM_LogImplementation.cpp:107 * Log object created. Default verbosity level is 'information'.2023-09-26:14:14:30MDT * 1 * information * 0x24210c0 * KIM_LogImplementation.cpp:242 * Log object renamed. ID changed to '0x2420c50_Collections'.2023-09-26:14:14:30MDT * 2 * information * 0x2420c50_Collections * KIM_LogImplementation.cpp:246 * Log object renamed. ID changed from '0x24210c0'.2023-09-26:14:14:30MDT * 3 * information * 0x2420c50_Collections * KIM_LogImplementation.cpp:119 * Log object destroyed.2023-09-26:14:14:30MDT * 1 * information * 0x2420c50 * KIM_LogImplementation.cpp:242 * Log object renamed. ID changed to '0_SimulatorModel'.2023-09-26:14:14:30MDT * 2 * information * 0_SimulatorModel * KIM_LogImplementation.cpp:246 * Log object renamed. ID changed from '0x2420c50'.2023-09-26:14:14:32MDT * 0 * information * 0_SimulatorModel * KIM_LogImplementation.cpp:119 * Log object destroyed.