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Patricio Fuentealba

Universidad Andres Bello

35H指数
105论文数
5.7K被引数
收录论文 21
发表时间
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Formation of complex organic molecules in ice mantles: An ab initio molecular dynamics study
errASTRONOMY & ASTROPHYSICS
IF5.8
err2019-08-30
err9
errOAAI
errInostroza, Natalia; Mardones, Diego; Cernicharo, Jose; Zinnecker, Hans; Ge, Jixing; Aria, Nelson; Fuentealba, Patricio; Cardenas, Carlos
err分享
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Understanding Chemical Reactivity in Extended Systems: Exploring Models of Chemical Softness in Carbon Nanotubes
erranalytica chimica acta
IF13.5
err2018-01-01
err12
PREAI
errCardenas, Carlos; Munoz, Macarena; Contreras, Julia; Ayers, Paul W.; Gomez, Tatiana; Fuentealba, Patricio
err分享
err收藏
Ferromagnetic bond of Li10 cluster: An alternative approach in terms of effective ferromagnetic sites
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2016-09-01
err4
PREAI
errDonoso, Roberto; Rossler, Jaime; Llano-Gil, Sandra; Fuentealba, Patricio; Cardenas, Carlos
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Insights into the hydrogen dissociation mechanism on lithium edge-decorated carbon rings and graphene nanoribbon
errINTERNATIONAL JOURNAL OF HYDROGEN ENERGY
IF8.3
err2016-04-01
err13
PREAI
errVasquez-Espinal, Alejandro; Pino-Rios, Ricardo; Fuentealba, Patricio; Orellana, Walter; Tiznado, William
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Comment on Going beyond the frozen core approximation: Development of coordinate-dependent pseudopotentials and application to Na2+ [J. Chem. Phys. 138, 054110 (2013)]
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2013-10-14
err0
errOAAI
errStoll, Hermann; Fuentealba, Patricio; von Szentpaly, Laszlo
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Ab Initio Molecular Dynamics Simulations of Ti2 on C20 Collisions and C20Ti2 Configurations
errJOURNAL OF PHYSICAL CHEMISTRY C
IF3.2
err2013-02-14
err3
PREAI
errMunoz, Francisco; Cardenas, Carlos; Rogan, Jose; Alejandro Valdivia, Juan; Fuentealba, Patricio; Kiwi, Miguel
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Topological Analysis of the Fukui Function
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2010-04-21
err109
PREAI
errFuentealba, Patricio; Florez, Elizabeth; Tiznado, William
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Theoretical Study of the Structure and Electronic Properties of Si3On- and Si6On- (n=1-6) Clusters. Fragmentation and Formation Patterns
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2009-07-31
err10
errOAAI
errTiznado, William; Ona, Ofelia B.; Caputo, Maria C.; Ferraro, Marta B.; Fuentealba, Patricio
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Effect of surface site on the spin state of first-row transition metals adsorbed on MgO:: Embedded cluster model and hybrid density functional theory calculations
errPHYSICAL REVIEW B
IF3.7
err2008-08-20
err9
PREAI
errFlorez, Elizabeth; Mondragon, Fanor; Fuentealba, Patricio; Illas, Francesc
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Chemical reactivity of oxygen vacancies on the MgO surface:: Reactions with CO2, NO2 and metals
errCATALYSIS TODAY
IF5.3
err2008-04-01
err69
PREAI
errFlorez, Elizabeth; Fuentealba, Patricio; Mondragon, Fanor
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Theoretical study of the surface reactivity of alkaline earth oxides:: Local density of states evaluation of the local softness
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2008-01-17
err33
PREAI
errCardenas, Carlos; De Proft, Frank; Chamorro, Eduardo; Fuentealba, Patricio; Geerlings, Paul
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Transition-metal atom adsorption on an Fs defect site of MgO (100) and the interaction with a hydrogen atom
errPHYSICAL REVIEW B
IF3.7
err2006-03-24
err12
PREAI
errFlorez, E; Mondragón, F; Truong, TN; Fuentealba, P
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Theoretical study of the adsorption of H on Sin clusters, (n=3-10) - art. no. 214302
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2005-12-02
err21
errOAAI
errTiznado, W; Oña, OB; Bazterra, VE; Caputo, MC; Facelli, JC; Ferraro, MB; Fuentealba, P
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Pseudopotential and electron propagator methods for the calculation of the photoelectron spectra of anionic silicon clusters:: Predictions on Si10- -: art. no. 144314
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2005-10-13
err7
PREAI
errTiznado, WA; Fuentealba, P; Ortiz, JV
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Relationships between the electrophilicity index and experimental rate coefficients for the aminolysis of thiolearbonates and dithiocarbonates
errJOURNAL OF ORGANIC CHEMISTRY
IF3.6
err2005-02-01
err48
PREAI
errCampodónico, RR; Fuentealba, P; Castro, EA; Santos, JG; Contreras, R
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An aromaticity scale based on the topological analysis of the electron localization function including σ and π contributions
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2004-11-20
err162
PREAI
errSantos, JC; Andres, J; Aizman, A; Fuentealba, P
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Sigma-pi separation of the electron localization function and aromaticity
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2004-01-22
err208
PREAI
errSantos, JC; Tiznado, W; Contreras, R; Fuentealba, P
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Local reactivity index defined through the density of states describes the basicity of alkaline-exchanged zeolites
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2002-03-08
err22
PREAI
errSantos, JC; Contreras, R; Chamorro, E; Fuentealba, P
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Topological analysis of the electron localization function applied to the study of the [1,3] sigmatropic shift of fluorine in 3-fluorpropene
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2001-01-01
err24
PREAI
errChamorro, E; Santos, JC; Gómez, B; Contreras, R; Fuentealba, P
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Some relationships within the nonlocal (pair-site) chemical reactivity formalism of density functional theory
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2000-12-22
err34
PREAI
errChamorro, E; Contreras, R; Fuentealba, P
err分享
err收藏

研究方向

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合作学者
合作期刊
F
Francesc Illas
H 指数: 92 · 论文数: 1.1K
J
J. Cernicharo
H 指数: 84 · 论文数: 1.1K
P
Paul W. Ayers
H 指数: 76 · 论文数: 518
J
Juán Andrés
H 指数: 72 · 论文数: 735
P
Paul Geerlings
H 指数: 68 · 论文数: 674
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