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 MatitoIkerbasque Professor at Donostia 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
Anton J. StasyukThe Institute of Computational Chemistry and Catalysis of the University of GironaVerified email at mail.muni.cz
Marc Garcia-BorràsUniversity of GironaVerified email at udg.edu
Olga A. StasyukThe Institute of Computational Chemistry and Catalysis of the University of GironaVerified email at udg.edu
Antoni LlobetInstitute of Chemical Research of Catalonia, ICIQVerified email at iciq.cat
NAZARIO MARTIN LEON - ORCID: 00...Univ. Complutense de Madrid, IMDEA NanoscienceVerified email at ucm.es
Teodor ParellaServei Ressonància Magnètica Nuclear - Universitat Autònoma de Barcelona - CataloniaVerified email at uab.cat
Francesc TeixidorProfessor d'investigació CSICVerified email at icmab.es
Jordi MestresChemotargets SLVerified email at chemotargets.com
Xavier FraderaComputational Chemistry, Blueprint MedicinesVerified email at blueprintmedicines.com
Dariusz SzczepanikDepartment of Theoretical Chemistry, Faculty of Chemistry, Jagiellonian UniversityVerified email at uj.edu.pl
Luigi CavalloKAUSTVerified email at kaust.edu.sa

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

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

Verified email at udg.edu - Homepage

Computational Chemistry Theoretical Chemistry Organometallic Chemistry Aromaticity Chemical


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ADF2017, SCM, Theoretical Chemistry, Vrije Universiteit, Amsterdam, The Netherlands EJ Baerends, T Ziegler, J Autschbach, D Bashford, A Bérces, ... ADF. Available online: http://www. scm. com (accessed on 20 April 2020), 2014	1996*	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	804	2005
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	538	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	521	2003
Forty years of Clar's aromatic π-sextet rule M Solà Frontiers in chemistry 1, 22, 2013	497	2013
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	461	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	425	2006
Quantifying aromaticity with electron delocalisation measures F Feixas, E Matito, J Poater, M Solà Chemical Society Reviews 44 (18), 6434-6451, 2015	416	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	321	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	318*	2014
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	282	2011
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	272	2006
Chemical bonding in transition metal carbene complexes G Frenking, M Solà, SF Vyboishchikov Journal of organometallic chemistry 690 (24-25), 6178-6204, 2005	268	2005
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	267*	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	259	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	244	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	219	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	213	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	211	2004
Comparison of the AIM Delocalization Index and the Mayer and Fuzzy Atom Bond Orders E Matito, J Poater, M Sola, M, Duran, P Salvador J. Phys. Chem. A 109, 9904-9910, 2005	208*	2005

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