Ecosyste.ms: Papers

An open API service providing mapping between scientific papers and software projects that are mentioned in them.
All mentions data is based on the CZI Software Mentions dataset.

Papers: 10.1038/s41597-020-00588-x

https://doi.org/10.1038/s41597-020-00588-x

Quantum chemical calculations for over 200,000 organic radical species and 40,000 associated closed-shell molecules

Cited by: 33
Author(s): Peter C. St. John, Yanfei Guan, Yeonjoon Kim, Brian D. Etz, Seonah Kim, Robert S. Paton
Published: over 4 years ago

Software Mentions 1

pypi: cclib
cclib: parsers and algorithms for computational chemistry
Papers that mentioned: 4