Directorio
ELENA RODRIGUEZ REMESAL
Categoría
Profesor Sustituto
Contacto
Correo electrónico
Departamento
Área
Química Física
Docencia
Investigación
Grupo de investigación
QUÍMICA TEÓRICA (QTEOR)
Proyectos y contratos de investigación
Diseño y modelización computacional de materiales termoeléctricos basados en calcogenuros y oxicalcogenuros metálicos (PID2019-106871GB-I00 - Participante)
Diseño y Modelización Computacional de Materiales Termoeléctricos Basados en Calcogenuros y Oxicalcogenuros Metálicos (PID2019-106871GB-I00 - Participante)
Capítulos en Libros
Amaya Suarez, Javier;Remesal, Elena R.;Plata-Ramos, José Javier;Márquez-Cruz, Antonio M.;Fdez. Sanz, Javier:
Computational modeling of carbon dioxide catalytic conversion . Pág. 620-640. WILEY-VCH VERLAG GMBH & CO. KGAA,. WILEY-VCH VERLAG GMBH & CO. KGAA,. 2020.
Computational modeling of carbon dioxide catalytic conversion . Pág. 620-640. WILEY-VCH VERLAG GMBH & CO. KGAA,. WILEY-VCH VERLAG GMBH & CO. KGAA,. 2020.
Remesal, Elena R.:
Potassium single atom adsorption on TiO2 (110) surface and the role of water. Pág. 207-215. Secretariado de Recursos Audiovisuales y Nuevas Tecnologías (Universidad de Sevilla). Secretariado de Recursos Audiovisuales y Nuevas Tecnologías (Universidad de Sevilla). 2017.
Potassium single atom adsorption on TiO2 (110) surface and the role of water. Pág. 207-215. Secretariado de Recursos Audiovisuales y Nuevas Tecnologías (Universidad de Sevilla). Secretariado de Recursos Audiovisuales y Nuevas Tecnologías (Universidad de Sevilla). 2017.
Asistencia a congresos
Posligua, Victor;Remesal, Elena R.;Plata-Ramos, José Javier;Márquez-Cruz, Antonio M.;Fdez. Sanz, Javier:
High-throughput screening of thermoelectric materials by machine learning. Sesión plenaria en Congreso. Químicos Teóricos Expresión Latina. , - Montevideo, Uruguay. 2023
High-throughput screening of thermoelectric materials by machine learning. Sesión plenaria en Congreso. Químicos Teóricos Expresión Latina. , - Montevideo, Uruguay. 2023
Remesal, Elena R.;Márquez-Cruz, Antonio M.;Blancas, Ernesto;Posligua, Victor;Plata-Ramos, José Javier;Fdez. Sanz, Javier:
Modelling the lattice thermal conductivity of skutterudites: ab¿initio calculations, machine learning and more. Poster en Congreso. 19th EUROPEAN CONFERENCE ON THERMOELECTRICS. Praga. 2023
Modelling the lattice thermal conductivity of skutterudites: ab¿initio calculations, machine learning and more. Poster en Congreso. 19th EUROPEAN CONFERENCE ON THERMOELECTRICS. Praga. 2023
Remesal, Elena R.;Graciani, Jesus;Rodriguez, Jose;Fdez. Sanz, Javier:
Water-Gas Shift Reaction on K Promoted Cu/TiO2 Surface. Poster en Congreso. International Conference Theoretical Aspects of Catalysis. Lyon (France). 2022
Water-Gas Shift Reaction on K Promoted Cu/TiO2 Surface. Poster en Congreso. International Conference Theoretical Aspects of Catalysis. Lyon (France). 2022
Remesal, Elena R.;Graciani, Jesus;Fdez. Sanz, Javier:
Water-Gas Shift Reaction on Cu/TiO2 Surfaces Promoted by Potassium. Poster en Congreso. 12th Congress on Electronic Structure: Principles and Applications. Vigo. 2022
Water-Gas Shift Reaction on Cu/TiO2 Surfaces Promoted by Potassium. Poster en Congreso. 12th Congress on Electronic Structure: Principles and Applications. Vigo. 2022
Remesal, Elena R.:
CO2 Activation Promoted by Potassium. Comunicación en congreso. TCCM Workshop -12th European Conference On Computational and Theoretical Chemistry (EUCO-CTC 2019). Perugia , Italia. 2019
CO2 Activation Promoted by Potassium. Comunicación en congreso. TCCM Workshop -12th European Conference On Computational and Theoretical Chemistry (EUCO-CTC 2019). Perugia , Italia. 2019
Remesal, Elena R.;Fdez. Sanz, Javier;Graciani, Jesus:
Potassium promoter role on TiO2 and Cu/TiO2 surfaces. Poster en Congreso. EUCO-CTC 2019. Perugia, Italia. 2019
Potassium promoter role on TiO2 and Cu/TiO2 surfaces. Poster en Congreso. EUCO-CTC 2019. Perugia, Italia. 2019
Remesal, Elena R.;Graciani, Jesus;Rodriguez, Jose A.;Fdez. Sanz, Javier:
CO2 ACTIVATION ON CU/TIO2 SURFACES PROMOTED BY POTASSIUM. Comunicación en congreso. 14 th International Congress on Chemical and Process Engineering. Bolonia. 2019
CO2 ACTIVATION ON CU/TIO2 SURFACES PROMOTED BY POTASSIUM. Comunicación en congreso. 14 th International Congress on Chemical and Process Engineering. Bolonia. 2019
Remesal, Elena R.;Fdez. Sanz, Javier;Graciani, Jesus;Márquez-Cruz, Antonio M.:
Catalytic activity: Potassium as a promoter. Poster en Congreso. XXXVII REUNIÓN BIENAL DE LA REAL SOCIEDAD ESPAÑOLA DE QUÍMICA. Donostia-San Sebastían. 2019
Catalytic activity: Potassium as a promoter. Poster en Congreso. XXXVII REUNIÓN BIENAL DE LA REAL SOCIEDAD ESPAÑOLA DE QUÍMICA. Donostia-San Sebastían. 2019
Fdez. Sanz, Javier;Plata-Ramos, José Javier;Graciani, Jesus;Remesal, Elena R.:
CeOx/TiO2 Nanostructured Interfaces as Highly Active Catalysts. Ponencia en Congreso. International Conference on Applied Catalysis and Chemical Engineering. DUBAI, E.A.U. 2019
CeOx/TiO2 Nanostructured Interfaces as Highly Active Catalysts. Ponencia en Congreso. International Conference on Applied Catalysis and Chemical Engineering. DUBAI, E.A.U. 2019
Remesal, Elena R.;Fdez. Sanz, Javier;Graciani, Jesus:
CO2 Activación on Cu/TiO2 Surfaces Promoted by potasium. Ponencia en Congreso. XI Jornada jovenes investigadores en física atómica y molecular. - CÁDIZ, - CÁDIZ, CADIZ,. 2019
CO2 Activación on Cu/TiO2 Surfaces Promoted by potasium. Ponencia en Congreso. XI Jornada jovenes investigadores en física atómica y molecular. - CÁDIZ, - CÁDIZ, CADIZ,. 2019
Remesal, Elena R.;Fdez. Sanz, Javier;Graciani, Jesus:
CO2 Activation on Cu/TiO2 Surfaces Promoted by Potassium. Poster en Congreso. 11TH CONGRESS ON ELECTRONIC STRUCTURE: PRINCIPLES AND APPLICATIONS. - Toledo, España. 2018
CO2 Activation on Cu/TiO2 Surfaces Promoted by Potassium. Poster en Congreso. 11TH CONGRESS ON ELECTRONIC STRUCTURE: PRINCIPLES AND APPLICATIONS. - Toledo, España. 2018
Remesal, Elena R.;Graciani, Jesus;Fdez. Sanz, Javier:
Promoting Water Dissociation on TiO2 (110) Surface: The Key Role of pre-Adsorbed Potassium Atoms.. Poster en Congreso. 25th International Symposium on chemical Reaction Engineering. FLORENCE. 2018
Promoting Water Dissociation on TiO2 (110) Surface: The Key Role of pre-Adsorbed Potassium Atoms.. Poster en Congreso. 25th International Symposium on chemical Reaction Engineering. FLORENCE. 2018
Remesal, Elena R.:
Improving Catalytic Activity: K-modified TiO2 Surface. Comunicación en congreso. International Workshop on Oxide Surfaces XI. Sierra Nevada, Granada, España. 2018
Improving Catalytic Activity: K-modified TiO2 Surface. Comunicación en congreso. International Workshop on Oxide Surfaces XI. Sierra Nevada, Granada, España. 2018
Remesal, Elena R.:
Potassium single atom adsorption on TiO2 (110) surface and the role of water. Poster en Congreso. IX JORNADAS DE JÓVENES INVESTIGADORES EN FÍSICA ATÓMICA Y MOLECULAR (J2IFAM 2017). Sevilla. 2017
Potassium single atom adsorption on TiO2 (110) surface and the role of water. Poster en Congreso. IX JORNADAS DE JÓVENES INVESTIGADORES EN FÍSICA ATÓMICA Y MOLECULAR (J2IFAM 2017). Sevilla. 2017
Remesal, Elena R.;Amaya Suarez, Javier;Márquez-Cruz, Antonio M.;Fdez. Sanz, Javier;Rincón, Cristina;Guitian, José:
Interfacial tension determination in hydrocarbon brine mixtures. Poster en Congreso. 10th Congress on Electronic Structure: Principles and Applications. CASTELLON, ESPAÑA. 2016
Interfacial tension determination in hydrocarbon brine mixtures. Poster en Congreso. 10th Congress on Electronic Structure: Principles and Applications. CASTELLON, ESPAÑA. 2016
Remesal, Elena R.:
Adsortion of organic molecules on silica. Effect of water multilayer and its salinity in aminoacids interaction. Comunicación en congreso. VII Jornadas de Jóvenes Investigadores en Física Atómica y Molecular (J2IFAM Jaén, 2015). - JAÉN, ESPAÑA, - UNIVERSIDAD DE JAÉN. 2015
Adsortion of organic molecules on silica. Effect of water multilayer and its salinity in aminoacids interaction. Comunicación en congreso. VII Jornadas de Jóvenes Investigadores en Física Atómica y Molecular (J2IFAM Jaén, 2015). - JAÉN, ESPAÑA, - UNIVERSIDAD DE JAÉN. 2015
Nuñez-Valdes, Juan;Rodríguez, Blanca;Remesal, Elena R.:
Primeras mujeres doctoras en Química en España. Comunicación en congreso. IV Congreso Universitario Nacional "Investigacion y Género". , UNIVERSIDAD DE SEVILLA, - ESPAÑA. 2012
Primeras mujeres doctoras en Química en España. Comunicación en congreso. IV Congreso Universitario Nacional "Investigacion y Género". , UNIVERSIDAD DE SEVILLA, - ESPAÑA. 2012
Remesal, Elena R.:
Promoting Water Dissociation on TiO2 (110) Surface: The Key Role of pre-Adsorbed Potassium Atoms.. Poster en Congreso. . .
Promoting Water Dissociation on TiO2 (110) Surface: The Key Role of pre-Adsorbed Potassium Atoms.. Poster en Congreso. . .
Artículos publicados
Remesal, Elena R.;Morales-garcía, Ángel;Illas, Francesc:
Role of N Doping in the Reduction of Titania Nanostructures. The Journal of Physical Chemistry C. 2023. Vol: 40. Núm: 127. Pág. 20128-20136. https://doi.org/10.1021/acs.jpcc.3c04665.
Role of N Doping in the Reduction of Titania Nanostructures. The Journal of Physical Chemistry C. 2023. Vol: 40. Núm: 127. Pág. 20128-20136. https://doi.org/10.1021/acs.jpcc.3c04665.
Amaya Suarez, Javier;Garcia-prieto, Cristina;Fernandez-martinez, Maria Dolores;Remesal, Elena R.;Márquez-Cruz, Antonio M.;Fdez. Sanz, Javier:
Optoelectronic properties of Ag2S/graphene and FeS2/graphene nanostructures and interfaces: A density functional study including dispersion forces. Journal of Materials Research. 2022. Vol: 37. Pág. 1047-1058. https://doi.org/10.1557/s43578-022-00509-1.
Optoelectronic properties of Ag2S/graphene and FeS2/graphene nanostructures and interfaces: A density functional study including dispersion forces. Journal of Materials Research. 2022. Vol: 37. Pág. 1047-1058. https://doi.org/10.1557/s43578-022-00509-1.
Remesal, Elena R.;Morales-garcía, Ángel:
Carbon-doped anatase titania nanoparticles: similarities and differences with respect to bulk and extended surface models. Physical Chemistry Chemical Physics. 2022. Vol: 24. Pág. 21381-21387. https://doi.org/10.1039/D2CP02455A.
Carbon-doped anatase titania nanoparticles: similarities and differences with respect to bulk and extended surface models. Physical Chemistry Chemical Physics. 2022. Vol: 24. Pág. 21381-21387. https://doi.org/10.1039/D2CP02455A.
Allès, Miquel;Remesal, Elena R.;Illas, Francesc;Morales-garcía, Ángel:
Structural and Electronic Properties of Metal/Oxide Nanostructures from First¿Principles: Ru13 Supported on (TiO2)84 as a Case Study. . ADVANCED THEORY AND SIMULATIONS. 2022. Vol: 6. Núm: 10. Pág. 2200670 (1)-2200670 (6). https://doi.org/10.1002/adts.202200670.
Structural and Electronic Properties of Metal/Oxide Nanostructures from First¿Principles: Ru13 Supported on (TiO2)84 as a Case Study. . ADVANCED THEORY AND SIMULATIONS. 2022. Vol: 6. Núm: 10. Pág. 2200670 (1)-2200670 (6). https://doi.org/10.1002/adts.202200670.
Rodríguez, Jose A.;Remesal, Elena R.;Graciani, Jesus; Ramírez, Pedro J.;Orozco, Ivan;Liu, Zongyuan;Senanayake, Sanjaya D.;Fdez. Sanz, Javier:
Water-Gas Shift Reaction on K/Cu(111) and Cu/K/TiO2(110) Surfaces: Alkali Promotion of Water Dissociation and Production of H2. ACS Catalysis. 2019. Vol: 9. Pág. 10751-10760. 10.1021/acscatal.9b03922.
Water-Gas Shift Reaction on K/Cu(111) and Cu/K/TiO2(110) Surfaces: Alkali Promotion of Water Dissociation and Production of H2. ACS Catalysis. 2019. Vol: 9. Pág. 10751-10760. 10.1021/acscatal.9b03922.
Plata-Ramos, José Javier;Remesal, Elena R.;Graciani, Jesus;Márquez-Cruz, Antonio M.;Rodríguez, Jose A.;Fdez. Sanz, Javier:
Understanding the Photocatalytic Properties of Pt/CeOx/TiO2: Structural Effects on Electronic and Optical Properties. Chemphyschem. 2019. Vol: 20. Pág. 1624-1629. 10.1002/cphc.201900141.
Understanding the Photocatalytic Properties of Pt/CeOx/TiO2: Structural Effects on Electronic and Optical Properties. Chemphyschem. 2019. Vol: 20. Pág. 1624-1629. 10.1002/cphc.201900141.
Remesal, Elena R.;Amaya Suarez, Javier;Márquez-Cruz, Antonio M.;Fdez. Sanz, Javier:
Adsorption of Prototypical Asphaltenes on Silica: First-Principles DFT Simulations Including Dispersion Corrections. The Journal of Physical Chemistry B. 2018. Vol: 122. Núm: 2. Pág. 618-624. 10.1021/acs.jpcb.7b05188.
Adsorption of Prototypical Asphaltenes on Silica: First-Principles DFT Simulations Including Dispersion Corrections. The Journal of Physical Chemistry B. 2018. Vol: 122. Núm: 2. Pág. 618-624. 10.1021/acs.jpcb.7b05188.
Plata-Ramos, José Javier;Pacheco, Laura C.;Remesal, Elena R.;Masa, Maria O.;Vega, Luis;Márquez-Cruz, Antonio M.;Odriozola-Gordon, José Antonio;Fdez. Sanz, Javier:
Analysis of the variables that modify the robustness of Ti-SiO2 catalysts for alkene epoxidation: Role of silylation, deactivation and potential solut. Molecular Catalysis. 2018. Vol: 459. Pág. 55-60. https://doi.org/10.1016/j.mcat.2018.08.010.
Analysis of the variables that modify the robustness of Ti-SiO2 catalysts for alkene epoxidation: Role of silylation, deactivation and potential solut. Molecular Catalysis. 2018. Vol: 459. Pág. 55-60. https://doi.org/10.1016/j.mcat.2018.08.010.
Remesal, Elena R.;Fdez. Sanz, Javier;Graciani-Alonso, Jesus:
Potassium and water coadsorption on TiO2(110): OH-Induced anchoring of potassium and the generation of single-site catalysts. The Journal of Physical Chemistry Letters. 2017. Vol: 7. Núm: 19. Pág. 3866-3872. 10.1021/acs.jpclett.6b01623.
Potassium and water coadsorption on TiO2(110): OH-Induced anchoring of potassium and the generation of single-site catalysts. The Journal of Physical Chemistry Letters. 2017. Vol: 7. Núm: 19. Pág. 3866-3872. 10.1021/acs.jpclett.6b01623.
Remesal, Elena R.;Amaya Suarez, Javier;Márquez-Cruz, Antonio M.;Fdez. Sanz, Javier:
Molecular Dynamics Simulations of the Role of Salinity and Temperature on the Hydrocarbon/Water Interfacial Tension . Theoretical Chemistry Accounts. 2017. Vol: 136. Núm: 66. DOI 10.1007/s00214-017-2096-9.
Molecular Dynamics Simulations of the Role of Salinity and Temperature on the Hydrocarbon/Water Interfacial Tension . Theoretical Chemistry Accounts. 2017. Vol: 136. Núm: 66. DOI 10.1007/s00214-017-2096-9.
Remesal, Elena R.;Amaya Suarez, Javier;Graciani, Jesus;Márquez-Cruz, Antonio M.;Fdez. Sanz, Javier:
Adsorption of prototypical amino acids on silica: Influence of the pre-adsorbed water multilayer. Surface science. 2016. Vol: 646. Pág. 239-246. 10.1016/j.susc.2015.07.012.
Adsorption of prototypical amino acids on silica: Influence of the pre-adsorbed water multilayer. Surface science. 2016. Vol: 646. Pág. 239-246. 10.1016/j.susc.2015.07.012.
