Reisel Millán (Reisel Millan)

Scopus Author ID ORCID

Publication Activity (10 Years)

Years Active: 2020-2024
Publications (10 Years): 8

Top Topics

Density Functional Theory

Molecular Dynamics

Perovskite Solar Cells

Top Venues

Angewandte Chemie (International ed. in English)

The journal of physical chemistry letters

Faraday discussions

This page only lists publications with an associated author ORCID identifier.

Publications

Ana Rubio-Gaspar, Alechania Misturini, Reisel Millán, Neyvis Almora-Barrios, Sergio Tatay, Volodymyr Bon, Mickaele Bonneau, Vincent Guillerm, Mohammed Eddaoudi, Sergio Navalón, Stefan Kaskel, Donatella Armentano, Carlos Martí-Gastaldo
Translocation and Confinement of Tetraamines in Adaptable Microporous Cavities. Angewandte Chemie (International ed. in English) 63 (30) (2024)
Ana Rubio-Gaspar, Alechania Misturini, Reisel Millán, Neyvis Almora-Barrios, Sergio Tatay, Volodymyr Bon, Mickaele Bonneau, Vincent Guillerm, Mohammed Eddaoudi, Sergio Navalón, Stefan Kaskel, Donatella Armentano, Carlos Martí-Gastaldo
Translocation and Confinement of Tetraamines in Adaptable Microporous Cavities. Angewandte Chemie (International ed. in English) (2024)
Reisel Millán, Estefanía Bello-Jurado, Manuel Moliner, Mercedes Boronat, Rafael Gomez-Bombarelli
Effect of Framework Composition and NH 3 on the Diffusion of Cu + in Cu-CHA Catalysts Predicted by Machine-Learning Accelerated Molecular Dynamics. ACS central science 9 (11) (2023)
Reisel Millán, María Dolores Soriano, Cristina Cerdá Moreno, Mercedes Boronat, Patricia Concepcion
Combined Spectroscopic and Computational Study of Nitrobenzene Activation on Non-Noble Metals-Based Mono- and Bimetallic Catalysts. Nanomaterials (Basel, Switzerland) 11 (8) (2021)
Reisel Millán, Pieter Cnudde, Veronique Van Speybroeck, Mercedes Boronat
Mobility and Reactivity of Cu+ Species in Cu-CHA Catalysts under NH3-SCR-NOx Reaction Conditions: Insights from AIMD Simulations. JACS Au 1 (10) (2021)
Reisel Millán, Mercedes Boronat
Hydrogenation of substituted nitroaromatics on non-noble metal catalysts: mechanistic insights to improve selectivity. Faraday discussions 229 (2021)
Pau Ferri, Chengeng Li, Reisel Millán, Joaquín Martínez-Triguero, Manuel Moliner, Mercedes Boronat, Avelino Corma
Impact of Zeolite Framework Composition and Flexibility on Methanol-To-Olefins Selectivity: Confinement or Diffusion? Angewandte Chemie (International ed. in English) 59 (44) (2020)
Reisel Millán, Pieter Cnudde, Alexander E J Hoffman, Christian Wittee Lopes, Patricia Concepcion, Veronique Van Speybroeck, Mercedes Boronat
Theoretical and Spectroscopic Evidence of the Dynamic Nature of Copper Active Sites in Cu-CHA Catalysts under Selective Catalytic Reduction (NH3-SCR-NOx) Conditions. The journal of physical chemistry letters 11 (23) (2020)