The DOI matches its Crossref record; 8 of the 8 references it cites were found in a registry or an index.
Challenges for Density Functional Theory
Abstract
ADVERTISEMENT RETURN TO ISSUEPREVReviewNEXTChallenges for Density Functional TheoryAron J. Cohen*, Paula Mori-Sánchez*, and Weitao YangView Author Information Department of Chemistry, Lensfield Road, University of Cambridge, Cambridge, CB2 1EW, United Kingdom Departamento de Química, Universidad Autónoma de Madrid, 28049 Madrid, Spain Department of Chemistry, French Family Science Center, Duke University, Durham, North Carolina, 27708, United States*E-mail: [email protected], [email protected] and [email protected]Cite this: Chem. Rev. 2012, 112, 1, 289–320Publication Date (Web):December 22, 2011Publication History Received5 April 2011Published online22 December 2011Published inissue 11 January 2012https://pubs.acs.org/doi/10.1021/cr200107zhttps://doi.org/10.1021/cr200107zreview-articleACS PublicationsCopyright © 2011 American Chemical SocietyRequest reuse permissionsArticle Views32911Altmetric-Citations1860LEARN 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 optionsGet e-Alertsclose SUBJECTS:Density functional theory,Electrical energy,Energy,Molecules,Quantum mechanics Get e-Alerts
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Cites
Generalized Gradient Approximation Made Simple
Perdew, J. P., Burke, K., & Ernzerhof, M. (1996) · Physical Review Letters · doi:10.1103/physrevlett.77.3865 · Cited by 215,824
Density-functional thermochemistry. III. The role of exact exchange
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Self-citationSelf-Consistent Equations Including Exchange and Correlation Effects
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Perdew, J. P., & Zunger, A. (1981) · Physical Review B · doi:10.1103/physrevb.23.5048 · Cited by 20,887
A new mixing of Hartree–Fock and local density-functional theories
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Cited by
Kondratenko, E. V., Mul, G., Baltrusaitis, J., Larrazábal, G. O., & Pérez-Ramírez, J. (2013) · Energy & Environmental Science · doi:10.1039/c3ee41272e · Cited by 1,802
Big Data Meets Quantum Chemistry Approximations: The Δ-Machine Learning Approach
Ramakrishnan, R., Dral, P. O., Rupp, M., & von Lilienfeld, O. A. (2015) · Journal of Chemical Theory and Computation · doi:10.1021/acs.jctc.5b00099 · Cited by 911
Theoretical Insights into Heterogeneous (Photo)electrochemical CO2Reduction
Xu, S., & Carter, E. A. (2019) · Chemical Reviews · doi:10.1021/acs.chemrev.8b00481 · Cited by 652
Prediction Errors of Molecular Machine Learning Models Lower than Hybrid DFT Error
Faber, F. A., Hutchison, L., Huang, B., Gilmer, J., Schoenholz, S. S., Dahl, G. E., Vinyals, O., Kearnes, S., Riley, P. F., & von Lilienfeld, O. A. (2017) · Journal of Chemical Theory and Computation · doi:10.1021/acs.jctc.7b00577 · Cited by 651
Mater, A. C., & Coote, M. L. (2019) · Journal of Chemical Information and Modeling · doi:10.1021/acs.jcim.9b00266 · Cited by 565
Metadata
- Authors
- Cohen, A. J., Mori-Sánchez, P., & Yang, W.
- Venue
- Chemical Reviews
- Publisher
- American Chemical Society (ACS)
- Published
- 2011-12-22
- Volume
- 112
- Issue
- 1
- Pages
- 289-320
- ISSN
- 0009-2665 (ISSN-L)
- 1520-6890
- OpenAlex
- W2028054907
- Cited by
- 2,541
- References
- 8
- FWCI
- 7.53
- Type
- journal article
- Language
- en
- Open access
- closed
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