narupatools.lammps.exceptions

Custom exceptions that wrap LAMMPS output.

Exceptions

AtomIDsNotDefinedError(func_name)	Error raised when gather/scatter commands are used without atom ids.
CannotOpenFileError(message)	Error raised when a file is not found by LAMMPS.
ComputeNotFoundError(key)	Error raised when a compute is requested which is not defined.
IllegalCommandError(message)	Error raised when a command is used incorrectly in LAMMPS.
InvalidComputeSpecificationError(key, style, …)	Error raised when a compute is requested where the types are not defined.
LAMMPSError(message)	Error raised by LAMMPS.
MissingInputScriptError(message)	Error raised when a file is not found by LAMMPS.
UnknownAtomPropertyError(key)	Error raised when gather_atoms is used to get a property which does not exist.
UnknownCommandError(message)	Error raised when an unknown command is used in LAMMPS.
UnknownPropertyNameError()	Error raised when lammps_gather_atoms encounters an unknown property name.
UnrecognizedStyleError(message)	Error raised when a style not recognized by LAMMPS is used.