Toward the Balance between the Reductionist and Systems Approaches in Computational Catalysis: Model versus Method Accuracy for the Description of Catalytic Systems

ADVERTISEMENT RETURN TO ISSUEPREVViewpointNEXTToward the Balance between the Reductionist and Systems Approaches in Computational Catalysis: Model versus Method Accuracy for the Description of Catalytic SystemsEvgeny A. Pidko*View Author Information Theoretical Chemistry Group, ITMO University, Lomonosova str. 9, St. Petersburg 191002, Russia Inorganic Materials Chemistry Group, Schuit Institute of Catalysis, and Institute for Complex Molecular Systems, Eindhoven University of Technology, P.O. Box 513, 5600 MB Eindhoven, The Netherlands*E-mail: [email protected] or [email protected]Cite this: ACS Catal. 2017, 7, 7, 4230–4234Publication Date (Web):May 16, 2017Publication History Received27 January 2017Published online24 May 2017Published inissue 7 July 2017https://pubs.acs.org/doi/10.1021/acscatal.7b00290https://doi.org/10.1021/acscatal.7b00290editorialACS PublicationsCopyright © 2017 American Chemical Society. This publication is available under these Terms of Use. Request reuse permissions This publication is free to access through this site. Learn MoreArticle Views4332Altmetric-Citations61LEARN 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 PDF (2 MB) Get e-AlertscloseSupporting Info (1)»Supporting Information Supporting Information SUBJECTS:Catalysis,Catalysts,Computational modeling,Theoretical models,Zeolites Get e-Alerts