#crystallography #chemistry #write #parse #atom #basic #parameters

crystal-cif-io

A library to parse and write crystallography cif format

2 releases

0.1.1 Dec 24, 2024
0.1.0 Dec 24, 2024

#465 in Science

MIT license

205KB
6K SLoC

crystal-cif-io

A crate to parse, edit and write crystallographic cif format. Targeting to read/write most basic atom coordinates and lattice parameters first.

Dependencies

~8.5MB
~177K SLoC