William Tiznado

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Alejandro Vasquez-EspinalUniversidad Arturo PratVerified email at unap.cl
Edison OsorioFacultad de Ciencias Naturales y Matemáticas, Universidad de Ibagué.Verified email at unibague.edu.co
Gabriel MerinoApplied Physics Department, Cinvestav, Merida. MexicoVerified email at cinvestav.mx
Juan José Torres-VegaCentro de Investigaciones Tecnológicas, Biomedicas y MedioambientalesVerified email at uandresbello.edu
Julio CaballeroUniversidad de TalcaVerified email at utalca.cl
Carlos CardenasProfessor, Universidad de ChileVerified email at uchile.cl
Franklin FerraroUniversidad Católica Luis AmigóVerified email at amigo.edu.co
Elizabeth FlorezUniversidad de MedellinVerified email at udem.edu.co
Rafael IslasUniversidad Andres BelloVerified email at unab.cl
Fanor MondragonUniversidad de AntioquiaVerified email at udea.edu.co
Miquel Solà Puig (ORCID: 0000-0002-...University of Girona / Universitat de Girona (GRID grid.5319.e / ROR 01xdxns91)Verified email at udg.edu
Eduard MatitoIkerbasque Professor at Donostia International Physics Center (DIPC)Verified email at dipc.org
Eduardo ChamorroProfesor Titular. Universidad San SebastiánVerified email at uss.cl
Patricia PérezUniversidad Andrés BelloVerified email at unab.cl
Jordi Poater - ORCID: 0000-0002-081...Universitat de Barcelona (UB) & ICREAVerified email at ub.edu
Alejandro Toro-LabbeLaboratorio de Química Teórica Computacional (QTC), Pontificia Universidad Catolica de ChileVerified email at puc.cl
Jesus M. Ugalde. Prof. of ChemistryEuskal Herriko Unibertsitatea (UPV/EHU) and Donostia International Physics Center (DIPC)Verified email at ehu.eus
Paul W. AyersProfessor of Chemistry & Chemical Biology, McMaster UniversityVerified email at chemistry.mcmaster.ca
Abril C. CastroHylleraas Centre for Quantum Molecular Sciences, University of OsloVerified email at kjemi.uio.no
Diego Vicente Moreno RodríguezUniversidad de Ciencias Aplicadas y Ambientales (UDCA), BogotáVerified email at udca.edu.co

William Tiznado

Departamento de Ciencias Químicas, Universidad Andres Bello, Chile

Verified email at unab.cl

Quantum Chemistry Clusters aromaticity chemical bonding exploration of the potential energy surface


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Sigma–pi separation of the electron localization function and aromaticity JC Santos, W Tiznado, R Contreras, P Fuentealba The Journal of chemical physics 120 (4), 1670-1673, 2004	272	2004
Definition of a nucleophilicity scale P Jaramillo, P Perez, R Contreras, W Tiznado, P Fuentealba The Journal of Physical Chemistry A 110 (26), 8181-8187, 2006	176	2006
Topological analysis of the Fukui function P Fuentealba, E Florez, W Tiznado Journal of chemical theory and computation 6 (5), 1470-1478, 2010	136	2010
Orbital-weighted dual descriptor for the study of local reactivity of systems with (quasi-) degenerate states R Pino-Rios, D Inostroza, G Cárdenas-Jirón, W Tiznado The Journal of Physical Chemistry A 123 (49), 10556-10562, 2019	130	2019
Comparison among four different ways to condense the Fukui function W Tiznado, E Chamorro, R Contreras, P Fuentealba The Journal of Physical Chemistry A 109 (14), 3220-3224, 2005	98	2005
Proposal of a simple and effective local reactivity descriptor through a topological analysis of an orbital‐weighted fukui function R Pino‐Rios, O Yañez, D Inostroza, L Ruiz, C Cardenas, P Fuentealba, ... Journal of Computational Chemistry 38 (8), 481-488, 2017	97	2017
Study of the differential activity of thrombin inhibitors using docking, QSAR, molecular dynamics, and MM-GBSA K Mena-Ulecia, W Tiznado, J Caballero PLoS One 10 (11), e0142774, 2015	97	2015
A proposal for a new local hardness as selectivity index L Meneses, W Tiznado, R Contreras, P Fuentealba Chemical physics letters 383 (1-2), 181-187, 2004	96	2004
Minimizing the risk of reporting false aromaticity and antiaromaticity in inorganic heterocycles following magnetic criteria JJ Torres-Vega, A Vásquez-Espinal, J Caballero, ML Valenzuela, ... Inorganic Chemistry 53 (7), 3579-3585, 2014	93	2014
Designing 3-D molecular stars W Tiznado, N Perez-Peralta, R Islas, A Toro-Labbe, JM Ugalde, G Merino Journal of the American Chemical Society 131 (26), 9426-9431, 2009	91	2009
Analysis of Why Boron Avoids sp² Hybridization and Classical Structures in the B_nH_n+2 Series E Osorio, JK Olson, W Tiznado, AI Boldyrev Chemistry–A European Journal 18 (31), 9677-9681, 2012	82	2012
The Fukui potential and the capacity of charge and the global hardness of atoms C Cárdenas, W Tiznado, PW Ayers, P Fuentealba The Journal of Physical Chemistry A 115 (11), 2325-2331, 2011	78	2011
Theoretical study of the antioxidant activity of quercetin oxidation products A Vásquez-Espinal, O Yañez, E Osorio, C Areche, O García-Beltrán, ... Frontiers in Chemistry 7, 818, 2019	74	2019
AUTOMATON: a program that combines a probabilistic cellular automata and a genetic algorithm for global minimum search of clusters and molecules O Yañez, R Báez-Grez, D Inostroza, WA Rabanal-León, R Pino-Rios, ... Journal of chemical theory and computation 15 (2), 1463-1475, 2019	74	2019
Theoretical study of the interaction of molecular oxygen with copper clusters E Florez, W Tiznado, F Mondragón, P Fuentealba The Journal of Physical Chemistry A 109 (34), 7815-7821, 2005	71	2005
Which NICS method is most consistent with ring current analysis? Assessment in simple monocycles R Báez-Grez, L Ruiz, R Pino-Rios, W Tiznado RSC advances 8 (24), 13446-13453, 2018	69	2018
Isomerization Energy Decomposition Analysis for Highly Ionic Systems: Case Study of Starlike E₅Li₇⁺ Clusters M Contreras, E Osorio, F Ferraro, G Puga, KJ Donald, JG Harrison, ... Chemistry–A European Journal 19 (7), 2305-2310, 2013	61	2013
Planar hexacoordinate carbons: half covalent, half ionic L Leyva‐Parra, L Diego, O Yañez, D Inostroza, J Barroso, ... Angewandte Chemie International Edition 60 (16), 8700-8704, 2021	59	2021
An analysis of the isomerization energies of 1, 2-/1, 3-diazacyclobutadiene, pyrazole/imidazole, and pyridazine/pyrimidine with the turn-upside-down approach M El-Hamdi, W Tiznado, J Poater, M Solà The Journal of Organic Chemistry 76 (21), 8913-8921, 2011	58	2011
Scalar and Spin−Orbit Relativistic Corrections to the NICS and the Induced Magnetic Field: The case of the E₁₂²⁻ Spherenes (E = Ge, Sn, Pb) AC Castro, E Osorio, JOC Jiménez-Halla, E Matito, W Tiznado, G Merino Journal of Chemical Theory and Computation 6 (9), 2701-2705, 2010	57	2010

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