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Nine questions on energy decomposition analysis.
Andrés, Juan; Ayers, Paul W; Boto, Roberto A; Carbó-Dorca, Ramon; Chermette, Henry; Cioslowski, Jerzy; Contreras-García, Julia; Cooper, David L; Frenking, Gernot; Gatti, Carlo; Heidar-Zadeh, Farnaz; Joubert, Laurent; Martín Pendás, Ángel; Matito, Eduard; Mayer, István; Misquitta, Alston J; Mo, Yirong; Pilmé, Julien; Popelier, Paul L A; Rahm, Martin; Ramos-Cordoba, Eloy; Salvador, Pedro; Schwarz, W H Eugen; Shahbazian, Shant; Silvi, Bernard; Solà, Miquel; Szalewicz, Krzysztof; Tognetti, Vincent; Weinhold, Frank; Zins, Émilie-Laure.
Afiliación
  • Andrés J; Departament de Ciències Experimentals Universitat Jaume I, 12080, Castelló, Spain.
  • Ayers PW; Department of Chemistry and Chemical Biology, McMaster University, 1280 Main Street West, L8S 4M1, Hamilton, Ontario, Canada.
  • Boto RA; CICECO, Aveiro, Portugal.
  • Carbó-Dorca R; Institut de Química Computational i Catàlisi, Universitat de Girona, C/M Aurelia Capmany 69, 17003, Girona, Spain.
  • Chermette H; Université Lyon 1 et UMR CNRS 5280 Institut Sciences Analytiques, Université de Lyon, 69622, Paris, France.
  • Cioslowski J; Institute of Physics, University of Szczecin, Wielkopolska, 15, 70-451, Szczecin, Poland.
  • Contreras-García J; Sorbonne Université, CNRS, LCT, UMR 7616, 4 place Jussieu, 75005, Paris, France.
  • Cooper DL; Department of Chemistry, University of Liverpool, Liverpool, L69 7ZD, United Kingdom.
  • Frenking G; Fachbereich Chemie, Philipps-Universität Marburg, Hans-Meerweinstr. 4, 35032, Marburg, Germany.
  • Gatti C; CNR-ISTM Istituto di Scienze e Tecnologie Molecolari, via Golgi 19, 20133, Milan, Italy and Istituto Lombardo Accademia di Scienze e Lettere, via Brera 28, 20121, Milan, Italy.
  • Heidar-Zadeh F; Physics and Materials Science Research Unit, University of Luxembourg, L-1511 Luxembourg, Luxembourg and Department of Chemistry, Queen's University, Kingston, Ontario K7L 3N6, Canada.
  • Joubert L; COBRA UMR 6014 & FR 3038, INSA Rouen, CNRS, Université de Rouen Normandie, Mont-St-Aignan, France.
  • Martín Pendás Á; Departamento de Química Física y Analítica, Universidad de Oviedo, 33006, Oviedo, Spain.
  • Matito E; Kimika Fakultatea, Euskal Herriko Unibertsitatea (UPV/EHU), and Donostia International Physics Center (DIPC), P.K. 1072, 20080, Donostia, Euskadi, Spain.
  • Mayer I; IKERBASQUE, Basque Foundation for Science, 48011, Bilbao, Euskadi, Spain.
  • Misquitta AJ; Institute of Organic Chemistry, Research Centre for Natural Sciences, Hungarian Academy of Sciences, Budapest, 1117, Hungary.
  • Mo Y; School of Physics and Astronomy, Queen Mary University of London, Mile End Road, London, E1 4NS, United Kingdom.
  • Pilmé J; Chemistry Department, Western Michigan University, Kalamazoo, Michigan, 49008.
  • Popelier PLA; Sorbonne Université, CNRS, LCT, UMR 7616, 4 place Jussieu, 75005, Paris, France.
  • Rahm M; Manchester Institute of Biotechnology (MIB), 131 Princess Street, Manchester, M1 7DN, United Kingdom.
  • Ramos-Cordoba E; School of Chemistry, University of Manchester, Oxford Road, Manchester, M13 9PL, United Kingdom.
  • Salvador P; Department of Chemistry and Chemical Engineering, Chalmers University of Technology, 412 96, Gothenburg, Sweden.
  • Schwarz WHE; Kimika Fakultatea, Euskal Herriko Unibertsitatea (UPV/EHU), and Donostia International Physics Center (DIPC), P.K. 1072, 20080, Donostia, Euskadi, Spain.
  • Shahbazian S; Institut de Química Computacional i Catàlisi, Universitat de Girona, C/M Aurelia Capmany 69, 17003, Girona, Spain.
  • Silvi B; Theoretical Chemistry Center at Tsinghua University, Beijing, 100084, China.
  • Solà M; Physical and Theoretical Chemistry Laboratory, Faculty of Science and Engineering, University of Siegen, Siegen, 57068, Germany.
  • Szalewicz K; Department of Physics, Shahid Beheshti University, P.O. Box 19395-4716, G. C., Evin, 19839, Tehran, Iran.
  • Tognetti V; Sorbonne Université, CNRS, LCT, UMR 7616, 4 place Jussieu, 75005, Paris, France.
  • Weinhold F; Institut de Química Computacional i Catàlisi, Universitat de Girona, C/M Aurelia Capmany 69, 17003, Girona, Spain.
  • Zins ÉL; Department of Physics and Astronomy, University of Delaware, Newark, Delaware.
J Comput Chem ; 40(26): 2248-2283, 2019 10 05.
Article en En | MEDLINE | ID: mdl-31251411
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Texto completo: 1 Base de datos: MEDLINE Asunto principal: Teoría Cuántica / Termodinámica Límite: Humans Idioma: En Revista: J Comput Chem Asunto de la revista: QUIMICA Año: 2019 Tipo del documento: Article País de afiliación: España
Texto completo
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Texto completo: 1 Base de datos: MEDLINE Asunto principal: Teoría Cuántica / Termodinámica Límite: Humans Idioma: En Revista: J Comput Chem Asunto de la revista: QUIMICA Año: 2019 Tipo del documento: Article País de afiliación: España