Dielectric continuum methods for quantum chemistry

• 資料種別: 記事
• タイトル: Dielectric continuum methods for quantum chemistry
• 著者標目: John M. Herbert; https://orcid.org/0000-0002-1663-2278
• 出版年月日等: 2021-03-23
• 出版年（W3CDTF）: 2021-03-23
• タイトル（掲載誌）: WIREs Computational Molecular Science
• 巻号年月日等（掲載誌）: 11 4
• 掲載巻: 11
• 掲載号: 4
• 掲載年月日（W3CDTF）: 2021-03-23
• ISSN（掲載誌）: 17590876
• 出版事項（掲載誌）: Wiley
• 件名標目: Materials Chemistry; Computational Mathematics; Physical and Theoretical Chemistry; Computer Science Applications; Biochemistry
• 対象利用者: 一般
• DOI: 10.1002/wcms.1519
• 作成日（W3CDTF）: 2021-03-24
• 著作権情報: http://onlinelibrary.wiley.com/termsAndConditions#am; http://onlinelibrary.wiley.com/termsAndConditions#vor
• 関連情報（URI）: https://onlinelibrary.wiley.com/doi/pdf/10.1002/wcms.1519; https://onlinelibrary.wiley.com/doi/full-xml/10.1002/wcms.1519; https://wires.onlinelibrary.wiley.com/doi/am-pdf/10.1002/wcms.1519; https://wires.onlinelibrary.wiley.com/doi/pdf/10.1002/wcms.1519
• 参照: Multireference Perturbation Theory Combined with PCM and RISM Solvation Models: A Benchmark Study for Chemical Energetics; https://cir.nii.ac.jp/crid/1360576118811433856
• 連携機関・データベース: 国立情報学研究所 : CiNii Research
• 提供元機関・データベース: Crossref; https://www.crossref.org

• 要約等: <jats:title>Abstract</jats:title><jats:p>This review describes the theory and implementation of implicit solvation models based on continuum electrost...