Miquel Solà Puig (ORCID: 0000-0002-1917-7450)

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Jordi Poater - ORCID: 0000-0002-081...Universitat de Barcelona (UB) & ICREAVerified email at ub.edu
Miquel DuranInstitute of Computational Chemistry and Department of Chemistry, University of Girona (UdG)Verified email at udg.edu
ALBERT POATER (ORCID:0000-0002...Universitat de GironaVerified email at udg.edu
Eduard MatitoDonostia International Physics Center (DIPC)Verified email at dipc.org
F.Matthias BickelhauptVU University AmsterdamVerified email at vu.nl
Josep M. LuisInstitute of Computational Chemistry, Department of Chemistry, University of GironaVerified email at udg.edu
Marcel SwartICREA; IQCC (Univ. Girona); Dept. Chem. (Univ. Girona)Verified email at icrea.cat
Silvia OsunaUniversitat de Girona & ICREAVerified email at udg.edu
Ferran FeixasInstitut de Química Computacional i Catàlisi (IQCC). University of Girona (Spain)Verified email at udg.edu
Marc Garcia-BorràsUniversity of GironaVerified email at udg.edu
Antoni LlobetInstitute of Chemical Research of Catalonia, ICIQVerified email at iciq.cat
Teodor ParellaServei Ressonància Magnètica Nuclear - Universitat Autònoma de Barcelona - CataloniaVerified email at uab.cat
NAZARIO MARTIN LEON - ORCID: 00...Univ. Complutense de Madrid, IMDEA NanoscienceVerified email at ucm.es
Jordi MestresIMIM Hospital del Mar Medical Research InstituteVerified email at imim.es
Anton J. StasyukThe Institute of Computational Chemistry and Catalysis of the University of GironaVerified email at mail.muni.cz
Xavier FraderaComputational Chemistry, Blueprint MedicinesVerified email at blueprintmedicines.com
Olga A. StasyukThe Institute of Computational Chemistry and Catalysis of the University of GironaVerified email at udg.edu
Sílvia SimonProfessor at University of Girona, Institute of Computational Chemistry, Department of Chemistry and Chair of Scientific CultureVerified email at udg.edu
Xavi RibasUniversitat de GironaVerified email at udg.edu
Francesc TeixidorProfessor d'investigació CSICVerified email at icmab.es

Miquel Solà Puig (ORCID: 0000-0002-1917-7450)

University of Girona (GRID grid.5319.e / ROR 01xdxns91)

Verified email at udg.edu - Homepage

Computational Chemistry Theoretical Chemistry Organometallic Chemistry Organic Chemistry Chemical bonding


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ADF2017, SCM, Theoretical Chemistry, Vrije Universiteit, Amsterdam, The Netherlands EJ Baerends, T Ziegler, J Autschbach, D Bashford, A Bérces, ... URL: http://www. scm. com, 2014	1728*	2014
Theoretical evaluation of electron delocalization in aromatic molecules by means of atoms in molecules (AIM) and electron localization function (ELF) topological approaches J Poater, M Duran, M Sola, B Silvi Chemical reviews 105 (10), 3911-3947, 2005	713	2005
The delocalization index as an electronic aromaticity criterion: application to a series of planar polycyclic aromatic hydrocarbons J Poater, X Fradera, M Duran, M Solà Chemistry–A European Journal 9 (2), 400-406, 2003	462	2003
The aromatic fluctuation index (FLU): a new aromaticity index based on electron delocalization E Matito, M Duran, M Solà The Journal of chemical physics 122 (1), 014109, 2005	454	2005
Theoretical studies of some transition-metal-mediated reactions of industrial and synthetic importance M Torrent, M Sola, G Frenking Chemical Reviews 100 (2), 439-494, 2000	435	2000
Hydrogen–hydrogen bonding in planar biphenyl, predicted by atoms‐in‐molecules theory, does not exist J Poater, M Solà, FM Bickelhaupt Chemistry–A European Journal 12 (10), 2889-2895, 2006	397	2006
Forty years of Clar's aromatic π-sextet rule M Solà Frontiers in chemistry 1, 22, 2013	371	2013
Quantifying aromaticity with electron delocalisation measures F Feixas, E Matito, J Poater, M Solà Chemical Society Reviews 44 (18), 6434-6451, 2015	322	2015
On the performance of some aromaticity indices: a critical assessment using a test set F Feixas, E Matito, J Poater, M Solà Journal of computational chemistry 29 (10), 1543-1554, 2008	286	2008
π Aromaticity and Three‐Dimensional Aromaticity: Two sides of the Same Coin? J Poater, M Solà, C Viñas, F Teixidor Angewandte Chemie International Edition 53 (45), 12191-12195, 2014	257*	2014
A model of the chemical bond must be rooted in quantum mechanics, provide insight, and possess predictive power J Poater, M Solà, FM Bickelhaupt Chemistry–A European Journal 12 (10), 2902-2905, 2006	257	2006
Chemical bonding in transition metal carbene complexes G Frenking, M Solà, SF Vyboishchikov Journal of organometallic chemistry 690 (24-25), 6178-6204, 2005	250	2005
Nucleophilic Aryl Fluorination and Aryl Halide Exchange Mediated by a Cu^I/Cu^III Catalytic Cycle A Casitas, M Canta, M Sola, M Costas, X Ribas Journal of the American Chemical Society 133 (48), 19386-19392, 2011	248	2011
Electron sharing indexes at the correlated level. Application to aromaticity calculations E Matito, M Solà, P Salvador, M Duran Faraday discussions 135, 325-345, 2007	230	2007
Local Aromaticity of [n]Acenes, [n]Phenacenes, and [n]Helicenes (n = 1−9) G Portella, J Poater, JM Bofill, P Alemany, M Sola The Journal of organic chemistry 70 (7), 2509-2521, 2005	228	2005
Polycyclic benzenoids: why kinked is more stable than straight J Poater, R Visser, M Sola, FM Bickelhaupt The Journal of Organic Chemistry 72 (4), 1134-1142, 2007	222	2007
Electron-pairing analysis from localization and delocalization indices in the framework of the atoms-in-molecules theory X Fradera, J Poater, S Simon, M Duran, M Solà Theoretical Chemistry Accounts 108, 214-224, 2002	208	2002
The calculation of electron localization and delocalization indices at the Hartree–Fock, density functional and post-Hartree–Fock levels of theory J Poater, M Solà, M Duran, X Fradera Theoretical Chemistry Accounts: Theory, Computation, and Modeling …, 2002	200	2002
Relation between the substituent effect and aromaticity TM Krygowski, K Ejsmont, BT Stepień, MK Cyrański, J Poater, M Sola The Journal of Organic Chemistry 69 (20), 6634-6640, 2004	191	2004
Assessment of Clar's aromatic π‐sextet rule by means of PDI, NICS and HOMA indicators of local aromaticity G Portella, J Poater, M Sola Journal of physical organic chemistry 18 (8), 785-791, 2005	174	2005

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