José Luís Cagide Fagín


AuthID: R-000-8EV

Confirmed Publications: 60



11
TITLE: Implicit solvent effects in the determination of Bronsted-Evans-Polanyi relationships for heterogeneously catalyzed reactions  Full Text
AUTHORS: Gomes, JRB; Vines, F; Illas, F; Fajin, JLC ;
PUBLISHED: 2019, SOURCE: PHYSICAL CHEMISTRY CHEMICAL PHYSICS, VOLUME: 21, ISSUE: 32
INDEXED IN: Scopus WOS CrossRef: 4
IN MY: ORCID
12
TITLE: Water gas shift reaction promoted by bimetallic catalysts: An experimental and theoretical overview
AUTHORS: Fajín, JLC ; Gomes, JRB;
PUBLISHED: 2018, SOURCE: Encyclopedia of Interfacial Chemistry: Surface Science and Electrochemistry
INDEXED IN: Scopus CrossRef: 2
IN MY: ORCID
13
TITLE: Prediction of metallic nanotube reactivity for H2O activation  Full Text
AUTHORS: Fajin, JLC ; Cordeiro, MNDS ; Gomes, JRB;
PUBLISHED: 2017, SOURCE: PHYSICAL CHEMISTRY CHEMICAL PHYSICS, VOLUME: 19, ISSUE: 29
INDEXED IN: Scopus WOS CrossRef: 1
IN MY: ORCID
14
15
TITLE: Water dissociation on multimetallic catalysts  Full Text
AUTHORS: Jose L C Fajin ; Natalia N D S Cordeiro ; Jose R B Gomes;
PUBLISHED: 2017, SOURCE: APPLIED CATALYSIS B-ENVIRONMENTAL, VOLUME: 218
INDEXED IN: Scopus WOS CrossRef: 14
IN MY: ORCID
16
TITLE: A computational study of the interaction of graphene structures with biomolecular units  Full Text
AUTHORS: Diego L Lopez Carballeira; Nicolas Ramos Berdullas; Ignacio Perez Juste; Jose Luis C Cagide Fajin ; Natalia N D S Cordeiro ; Marcos Mandado;
PUBLISHED: 2016, SOURCE: PHYSICAL CHEMISTRY CHEMICAL PHYSICS, VOLUME: 18, ISSUE: 22
INDEXED IN: Scopus WOS CrossRef: 17
IN MY: ORCID
17
TITLE: Effect of the Exchange-Correlation Potential on the Transferability of Bronsted-Evans-Polanyi Relationships in Heterogeneous Catalysis  Full Text
AUTHORS: Jose L C Fajin ; Francesc Vines; Natalia N D S Cordeiro ; Francesc Illas; Jose R B Gomes;
PUBLISHED: 2016, SOURCE: JOURNAL OF CHEMICAL THEORY AND COMPUTATION, VOLUME: 12, ISSUE: 5
INDEXED IN: Scopus WOS CrossRef: 20
IN MY: ORCID
18
TITLE: Effect of van der Waals interactions in the DFT description of self-assembled monolayers of thiols on gold
AUTHORS: Jose L C Fajin ; Filipe Teixeira; Jose R B Gomes; Natalia N D S Cordeiro ;
PUBLISHED: 2016, SOURCE: 9th Congress on Electronic Structure - Principles and Applications (ESPA) in 9TH CONGRESS ON ELECTRONIC STRUCTURE: PRINCIPLES AND APPLICATIONS (ESPA 2014), VOLUME: 11
INDEXED IN: WOS
19
20
TITLE: Competitive Paths for Methanol Decomposition on Ruthenium: A DFT Study
AUTHORS: Ana S Moura ; Jose L C Fajin ; Ana S S Pinto; Marcos Mandado; Natalia N D S Cordeiro ;
PUBLISHED: 2015, SOURCE: JOURNAL OF PHYSICAL CHEMISTRY C, VOLUME: 119, ISSUE: 49
INDEXED IN: Scopus WOS CrossRef: 24
IN MY: ORCID
Página 2 de 6. Total de resultados: 60.

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