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: ----------------------- BFGS: 8 10:42:59 -0.060201 0.022386BFGS: 9 10:42:59 -0.062949 0.022854BFGS: 10 10:43:00 -0.065629 0.023143BFGS: 11 10:43:00 -0.068199 0.023206BFGS: 12 10:43:00 -0.070606 0.022991BFGS: 13 10:43:00 -0.072790 0.022437BFGS: 14 10:43:00 -0.074679 0.021475BFGS: 15 10:43:00 -0.076194 0.020025BFGS: 16 10:43:00 -0.077247 0.021400BFGS: 17 10:43:00 -0.077748 0.026110BFGS: 18 10:43:00 -0.077821 0.027529BFGS: 19 10:43:01 -0.077947 0.028749BFGS: 20 10:43:01 -0.078491 0.032181BFGS: 21 10:43:01 -0.079459 0.035614BFGS: 22 10:43:01 -0.080889 0.038212BFGS: 23 10:43:01 -0.082779 0.039904BFGS: 24 10:43:01 -0.085089 0.040584BFGS: 25 10:43:01 -0.087795 0.040661BFGS: 26 10:43:01 -0.090895 0.045116BFGS: 27 10:43:02 -0.094414 0.049218 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":19.23,"usertime":29.64,"systime":51.42,"memmax":134772,"memavg":0} output/kim.log: --------------- 2023-05-04:10:42:58CDT * 0 * information * 0x2584b60 * KIM_LogImplementation.cpp:110 * Log object created. Default verbosity level is 'information'.2023-05-04:10:42:58CDT * 1 * information * 0x2584b60 * KIM_LogImplementation.cpp:242 * Log object renamed. ID changed to '0_Collections'.2023-05-04:10:42:58CDT * 2 * information * 0_Collections * KIM_LogImplementation.cpp:246 * Log object renamed. ID changed from '0x2584b60'.2023-05-04:10:42:58CDT * 3 * information * 0_Collections * KIM_LogImplementation.cpp:120 * Log object destroyed.2023-05-04:10:42:58CDT * 0 * information * 0x2584b60 * KIM_LogImplementation.cpp:110 * Log object created. Default verbosity level is 'information'.2023-05-04:10:42:58CDT * 0 * information * 0x25865d0 * KIM_LogImplementation.cpp:110 * Log object created. Default verbosity level is 'information'.2023-05-04:10:42:58CDT * 1 * information * 0x25865d0 * KIM_LogImplementation.cpp:242 * Log object renamed. ID changed to '0x2584b60_Collections'.2023-05-04:10:42:58CDT * 2 * information * 0x2584b60_Collections * KIM_LogImplementation.cpp:246 * Log object renamed. ID changed from '0x25865d0'.2023-05-04:10:42:58CDT * 3 * information * 0x2584b60_Collections * KIM_LogImplementation.cpp:120 * Log object destroyed.2023-05-04:10:42:58CDT * 1 * information * 0x2584b60 * KIM_LogImplementation.cpp:242 * Log object renamed. ID changed to '0_SimulatorModel'.2023-05-04:10:42:58CDT * 2 * information * 0_SimulatorModel * KIM_LogImplementation.cpp:246 * Log object renamed. ID changed from '0x2584b60'.2023-05-04:10:42:58CDT * 3 * information * 0_SimulatorModel * KIM_LogImplementation.cpp:120 * Log object destroyed.2023-05-04:10:42:58CDT * 0 * information * 0x2584b60 * KIM_LogImplementation.cpp:110 * Log object created. Default verbosity level is 'information'.2023-05-04:10:42:58CDT * 0 * information * 0x2585200 * KIM_LogImplementation.cpp:110 * Log object created. Default verbosity level is 'information'.2023-05-04:10:42:58CDT * 1 * information * 0x2585200 * KIM_LogImplementation.cpp:242 * Log object renamed. ID changed to '0x2584b60_Collections'.2023-05-04:10:42:58CDT * 2 * information * 0x2584b60_Collections * KIM_LogImplementation.cpp:246 * Log object renamed. ID changed from '0x2585200'.2023-05-04:10:42:58CDT * 3 * information * 0x2584b60_Collections * KIM_LogImplementation.cpp:120 * Log object destroyed.2023-05-04:10:42:58CDT * 1 * information * 0x2584b60 * KIM_LogImplementation.cpp:242 * Log object renamed. ID changed to '0_SimulatorModel'.2023-05-04:10:42:58CDT * 2 * information * 0_SimulatorModel * KIM_LogImplementation.cpp:246 * Log object renamed. ID changed from '0x2584b60'.2023-05-04:10:43:02CDT * 0 * information * 0_SimulatorModel * KIM_LogImplementation.cpp:120 * Log object destroyed.