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: ----------------------- cell = [[4.651, 0, 0], [-2.3255, 4.0278841530014, 0], [0, 0, 3.7169]]========================================= Step Time Energy fmaxBFGS: 0 10:51:18 -0.018085 0.012045BFGS: 1 10:51:18 -0.018090 0.012045BFGS: 2 10:51:18 -0.019543 0.011910BFGS: 3 10:51:18 -0.020976 0.011362BFGS: 4 10:51:18 -0.022341 0.010255BFGS: 5 10:51:19 -0.023571 0.008519BFGS: 6 10:51:19 -0.024578 0.006922BFGS: 7 10:51:19 -0.025245 0.004519BFGS: 8 10:51:19 -0.025421 0.004428BFGS: 9 10:51:19 -0.025434 0.002934BFGS: 10 10:51:20 -0.025434 0.003094BFGS: 11 10:51:20 -0.025435 0.003195BFGS: 12 10:51:20 -0.025436 0.003433BFGS: 13 10:51:20 -0.025440 0.003771BFGS: 14 10:51:21 -0.025451 0.004346BFGS: 15 10:51:21 -0.025479 0.005253BFGS: 16 10:51:21 -0.025552 0.006778 output/pipeline.stderr: ----------------------- File "../../td/EquilibriumCrystalStructure__TD_457028483760_000/runner", line 156, in forces = atoms.get_forces() File "/usr/local/lib/python3.8/dist-packages/ase/atoms.py", line 787, in get_forces forces = self._calc.get_forces(self) File "/usr/local/lib/python3.8/dist-packages/ase/calculators/abc.py", line 30, in get_forces return self.get_property('forces', atoms) File "/usr/local/lib/python3.8/dist-packages/ase/calculators/calculator.py", line 500, 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":27.79,"usertime":35.39,"systime":49.89,"memmax":138544,"memavg":0} output/kim.log: --------------- 2023-05-03:10:51:17CDT * 0 * information * 0x2b29e10 * KIM_LogImplementation.cpp:110 * Log object created. Default verbosity level is 'information'.2023-05-03:10:51:17CDT * 1 * information * 0x2b29e10 * KIM_LogImplementation.cpp:242 * Log object renamed. ID changed to '0_Collections'.2023-05-03:10:51:17CDT * 2 * information * 0_Collections * KIM_LogImplementation.cpp:246 * Log object renamed. ID changed from '0x2b29e10'.2023-05-03:10:51:17CDT * 3 * information * 0_Collections * KIM_LogImplementation.cpp:120 * Log object destroyed.2023-05-03:10:51:17CDT * 0 * information * 0x2b29e10 * KIM_LogImplementation.cpp:110 * Log object created. Default verbosity level is 'information'.2023-05-03:10:51:17CDT * 0 * information * 0x2b2b2d0 * KIM_LogImplementation.cpp:110 * Log object created. Default verbosity level is 'information'.2023-05-03:10:51:17CDT * 1 * information * 0x2b2b2d0 * KIM_LogImplementation.cpp:242 * Log object renamed. ID changed to '0x2b29e10_Collections'.2023-05-03:10:51:17CDT * 2 * information * 0x2b29e10_Collections * KIM_LogImplementation.cpp:246 * Log object renamed. ID changed from '0x2b2b2d0'.2023-05-03:10:51:17CDT * 3 * information * 0x2b29e10_Collections * KIM_LogImplementation.cpp:120 * Log object destroyed.2023-05-03:10:51:17CDT * 1 * information * 0x2b29e10 * KIM_LogImplementation.cpp:242 * Log object renamed. ID changed to '0_SimulatorModel'.2023-05-03:10:51:17CDT * 2 * information * 0_SimulatorModel * KIM_LogImplementation.cpp:246 * Log object renamed. ID changed from '0x2b29e10'.2023-05-03:10:51:17CDT * 3 * information * 0_SimulatorModel * KIM_LogImplementation.cpp:120 * Log object destroyed.2023-05-03:10:51:17CDT * 0 * information * 0x2b29e10 * KIM_LogImplementation.cpp:110 * Log object created. Default verbosity level is 'information'.2023-05-03:10:51:17CDT * 0 * information * 0x2b2a460 * KIM_LogImplementation.cpp:110 * Log object created. Default verbosity level is 'information'.2023-05-03:10:51:17CDT * 1 * information * 0x2b2a460 * KIM_LogImplementation.cpp:242 * Log object renamed. ID changed to '0x2b29e10_Collections'.2023-05-03:10:51:17CDT * 2 * information * 0x2b29e10_Collections * KIM_LogImplementation.cpp:246 * Log object renamed. ID changed from '0x2b2a460'.2023-05-03:10:51:17CDT * 3 * information * 0x2b29e10_Collections * KIM_LogImplementation.cpp:120 * Log object destroyed.2023-05-03:10:51:17CDT * 1 * information * 0x2b29e10 * KIM_LogImplementation.cpp:242 * Log object renamed. ID changed to '0_SimulatorModel'.2023-05-03:10:51:17CDT * 2 * information * 0_SimulatorModel * KIM_LogImplementation.cpp:246 * Log object renamed. ID changed from '0x2b29e10'.2023-05-03:10:51:22CDT * 0 * information * 0_SimulatorModel * KIM_LogImplementation.cpp:120 * Log object destroyed.