AtO

Minimalistic Rust implementation of atomic basis functions.
The data of the basis sets will be automatically downloaded from the Basis Set Exchange API.

Citation:

When publishing results obtained from use of the Basis Set Exchange software, please cite:
A New Basis Set Exchange: An Open, Up-to-date Resource for the Molecular Sciences Community.
Benjamin P. Pritchard, Doaa Altarawy, Brett Didier, Tara D. Gibson, Theresa L. Windus.
J. Chem. Inf. Model. 2019, 59(11), 4814-4820, doi:10.1021/acs.jcim.9b00725.

License

^{Licensed under either of Apache License, Version 2.0 or MIT license at your option.}
_{Unless you explicitly state otherwise, any contribution intentionally submitted for inclusion in this crate by you, as defined in the Apache-2.0 license, shall be dual licensed as above, without any additional terms or conditions.}