"""This module contains the WriteRestart class for LAMMPS write_restart commands."""
from dataclasses import dataclass, field
from irradiapy.lammps.commands.command import Command
[docs]
@dataclass(kw_only=True)
class WriteRestart(Command):
"""Class representing a LAMMPS write_restart command.
Reference
---------
https://docs.lammps.org/write_restart.html
"""
file: str
kw_vals: dict[str, str] = field(default_factory=dict)
def __post_init__(self) -> None:
self.file = str(self.file)
self.kw_vals = {str(key): str(value) for key, value in self.kw_vals.items()}
[docs]
def command(self) -> str:
"""Generate the LAMMPS command."""
kw_vals_str = (
" " + " ".join(f"{key} {value}" for key, value in self.kw_vals.items())
if self.kw_vals
else ""
)
return f"write_restart {self.file}{kw_vals_str}"