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cclib: A library for package‐independent computational chemistry algorithms

The work

AuthorsN. M. O’boyle; A. L. Tenderholt; K. M. Langner
Editors
Typemisc
Year2008
Also known asanon2007cclib, oboyle2007cclib
Citekeyoboyle2008cclib

Where it appeared

PublisherWiley

Identifiers

DOI10.1002/jcc.20823

How it got here

How it got hereagent via unpaywall
Added2026-10-29 05:45 UTC
Not denied bya person 2026-10-29 17:12 UTC

Cite it as

@misc{oboyle2008cclib,
  title        = {cclib: A library for package‐independent computational chemistry algorithms},
  author       = {N. M. O’boyle and A. L. Tenderholt and K. M. Langner},
  year         = {2008},
  publisher    = {Wiley},
  doi          = {10.1002/jcc.20823},
}

This record lives at https://refs.drheap.org/oboyle2008cclib/ and will keep doing so. It used to be called anon2007cclib, oboyle2007cclib, and those addresses still resolve to this one.