castep-cell-io 0.4.0

I/O library for CASTEP .cell and .param file formats
Documentation
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mod positions_frac;
pub use positions_frac::PositionsFrac;

mod positions_frac_intermediate;
pub use positions_frac_intermediate::PositionsFracIntermediate;

mod positions_frac_product;
pub use positions_frac_product::PositionsFracProduct;

mod positions_abs;
pub use positions_abs::{PositionsAbs, PositionAbsEntry};

mod positions_abs_intermediate;
pub use positions_abs_intermediate::{PositionsAbsIntermediate, PositionAbsIntermediateEntry};

mod positions_abs_product;
pub use positions_abs_product::{PositionsAbsProduct, PositionAbsProductEntry};