Source code for clease.montecarlo.constraints.fixed_element

from clease.datastructures.system_changes import SystemChanges
from .mc_constraint import MCConstraint


[docs]class FixedElement(MCConstraint): """ Class for forcing an element of a certiain type to stay fixed. Parameters: element: str Name of the element that is supposed to stay fixed """ def __init__(self, element): self.element = element def __call__(self, system_changes: SystemChanges): for change in system_changes: if self.element in (change.old_symb, change.new_symb): return False return True