castep_param_io/param/geom_opt/
geom_max_iter.rs

1use castep_param_derive::KeywordDisplay;
2use serde::{Deserialize, Serialize};
3
4#[derive(
5    Debug, Clone, Copy, PartialEq, Eq, PartialOrd, Ord, Serialize, Deserialize, Hash, KeywordDisplay,
6)]
7#[keyword_display(field = "GEOM_MAX_ITER", from=u32,value=u32, default_value=30)]
8/// This keyword determines the maximum number of steps in a geometry optimization.
9/// # Default
10/// 30
11/// # Example
12/// `GEOM_MAX_ITER : 25`
13pub struct GeomMaxIter(u32);