Abstract
ADVERTISEMENT RETURN TO ISSUEArticleNEXTAb Initio Calculation of Vibrational Absorption and Circular Dichroism Spectra Using Density Functional Force FieldsP. J. Stephens, F. J. Devlin, C. F. Chabalowski, and M. J. FrischCite this: J. Phys. Chem. 1994, 98, 45, 11623–11627Publication Date (Print):November 1, 1994Publication History Published online1 May 2002Published inissue 1 November 1994https://pubs.acs.org/doi/10.1021/j100096a001https://doi.org/10.1021/j100096a001research-articleACS PublicationsRequest reuse permissionsArticle Views22554Altmetric-Citations18558LEARN ABOUT THESE METRICSArticle Views are the COUNTER-compliant sum of full text article downloads since November 2008 (both PDF and HTML) across all institutions and individuals. These metrics are regularly updated to reflect usage leading up to the last few days.Citations are the number of other articles citing this article, calculated by Crossref and updated daily. Find more information about Crossref citation counts.The Altmetric Attention Score is a quantitative measure of the attention that a research article has received online. Clicking on the donut icon will load a page at altmetric.com with additional details about the score and the social media presence for the given article. Find more information on the Altmetric Attention Score and how the score is calculated. Share Add toView InAdd Full Text with ReferenceAdd Description ExportRISCitationCitation and abstractCitation and referencesMore Options Share onFacebookTwitterWechatLinked InRedditEmail Other access options Get e-Alerts
Keywords
Ab initioIconDensity functional theoryCitationAbsorption (acoustics)PhysicsSpectral lineInformation retrievalComputer scienceWorld Wide WebOpticsQuantum mechanics
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Publication Info
- Year
- 1994
- Type
- article
- Volume
- 98
- Issue
- 45
- Pages
- 11623-11627
- Citations
- 22156
- Access
- Closed
External Links
Social Impact
Altmetric
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Social media, news, blog, policy document mentions
Citation Metrics
22156
OpenAlex
173
Influential
21049
CrossRef
Cite This
Philip J. Stephens,
F. J. Devlin,
Cary F. Chabalowski
et al.
(1994).
Ab Initio Calculation of Vibrational Absorption and Circular Dichroism Spectra Using Density Functional Force Fields.
The Journal of Physical Chemistry
, 98
(45)
, 11623-11627.
https://doi.org/10.1021/j100096a001
Identifiers
- DOI
- 10.1021/j100096a001