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: ----------------------- AFLOW prototype label:A2B_oP12_62_2c_cParameter names:['a', 'b/a', 'c/a', 'x1', 'z1', 'x2', 'z2', 'x3', 'z3']model type (only 'standard' supported at this time):standardnumber of parameter sets:1Parameter values for parameter set 0:['7.6084', '0.6326823', '1.1892776', '0.3464605', '0.92627319', '0.47962367', '0.32267916', '0.74735771', '0.89410375']model name:Sim_LAMMPS_Buckingham_FreitasSantosColaco_2015_SiCaOAl__SM_154093256665_000==== Building ASE atoms object with: ====representative atom symbols = ['Ca', 'Ca', 'Si']representative atom coordinates = [[0.3464605 0.25 0.92627319] [0.47962367 0.25 0.32267916] [0.74735771 0.25 0.89410375]]spacegroup = 62cell = [[7.6084, 0, 0], [0, 4.8137, 0], [0, 0, 9.0485]]========================================= 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 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: All pair coeffs are not set (src/pair.cpp:249)Command exited with non-zero status 1{"realtime":18.24,"usertime":26.54,"systime":43.32,"memmax":138220,"memavg":0} output/kim.log: --------------- 2023-07-05:14:38:28CDT * 0 * information * 0x35e7b40 * KIM_LogImplementation.cpp:107 * Log object created. Default verbosity level is 'information'.2023-07-05:14:38:28CDT * 1 * information * 0x35e7b40 * KIM_LogImplementation.cpp:242 * Log object renamed. ID changed to '0_Collections'.2023-07-05:14:38:28CDT * 2 * information * 0_Collections * KIM_LogImplementation.cpp:246 * Log object renamed. ID changed from '0x35e7b40'.2023-07-05:14:38:28CDT * 3 * information * 0_Collections * KIM_LogImplementation.cpp:119 * Log object destroyed.2023-07-05:14:38:28CDT * 0 * information * 0x35e7b40 * KIM_LogImplementation.cpp:107 * Log object created. Default verbosity level is 'information'.2023-07-05:14:38:28CDT * 0 * information * 0x35e81e0 * KIM_LogImplementation.cpp:107 * Log object created. Default verbosity level is 'information'.2023-07-05:14:38:28CDT * 1 * information * 0x35e81e0 * KIM_LogImplementation.cpp:242 * Log object renamed. ID changed to '0x35e7b40_Collections'.2023-07-05:14:38:28CDT * 2 * information * 0x35e7b40_Collections * KIM_LogImplementation.cpp:246 * Log object renamed. ID changed from '0x35e81e0'.2023-07-05:14:38:28CDT * 3 * information * 0x35e7b40_Collections * KIM_LogImplementation.cpp:119 * Log object destroyed.2023-07-05:14:38:28CDT * 1 * information * 0x35e7b40 * KIM_LogImplementation.cpp:242 * Log object renamed. ID changed to '0_SimulatorModel'.2023-07-05:14:38:28CDT * 2 * information * 0_SimulatorModel * KIM_LogImplementation.cpp:246 * Log object renamed. ID changed from '0x35e7b40'.2023-07-05:14:38:28CDT * 3 * information * 0_SimulatorModel * KIM_LogImplementation.cpp:119 * Log object destroyed.2023-07-05:14:38:28CDT * 0 * information * 0x35e7b40 * KIM_LogImplementation.cpp:107 * Log object created. Default verbosity level is 'information'.2023-07-05:14:38:28CDT * 0 * information * 0x35e9950 * KIM_LogImplementation.cpp:107 * Log object created. Default verbosity level is 'information'.2023-07-05:14:38:28CDT * 1 * information * 0x35e9950 * KIM_LogImplementation.cpp:242 * Log object renamed. ID changed to '0x35e7b40_Collections'.2023-07-05:14:38:28CDT * 2 * information * 0x35e7b40_Collections * KIM_LogImplementation.cpp:246 * Log object renamed. ID changed from '0x35e9950'.2023-07-05:14:38:28CDT * 3 * information * 0x35e7b40_Collections * KIM_LogImplementation.cpp:119 * Log object destroyed.2023-07-05:14:38:28CDT * 1 * information * 0x35e7b40 * KIM_LogImplementation.cpp:242 * Log object renamed. ID changed to '0_SimulatorModel'.2023-07-05:14:38:28CDT * 2 * information * 0_SimulatorModel * KIM_LogImplementation.cpp:246 * Log object renamed. ID changed from '0x35e7b40'.2023-07-05:14:38:29CDT * 0 * information * 0_SimulatorModel * KIM_LogImplementation.cpp:119 * Log object destroyed.