Manuel F Ruiz-Lopez (Manuel F Ruiz-López)

ResearcherID ORCID

Publication Activity (10 Years)

Years Active: 2017-2024
Publications (10 Years): 32

Top Topics

Molecular Dynamics Simulations

Energy Transfer

Top Venues

Journal of the American Chemical Society

Chemphyschem : a European journal of chemical physics and physical chemistry

The journal of physical chemistry. A

The journal of physical chemistry. B

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

Publications

Josep M Anglada, Marilia T C Martins-Costa, Joseph S Francisco, Manuel F Ruiz-Lopez
Triplet State Radical Chemistry: Significance of the Reaction of 3 SO 2 with HCOOH and HNO 3 . Journal of the American Chemical Society 146 (20) (2024)
Marilia T C Martins-Costa, Manuel F Ruiz-Lopez
Reactivity of Monoethanolamine at the Air-Water Interface and Implications for CO 2 Capture. The journal of physical chemistry. B 128 (5) (2024)
Josep M Anglada, Marilia T C Martins-Costa, Joseph S Francisco, Manuel F Ruiz-Lopez
Triplet State Radical Chemistry: Significance of the Reaction of 3 SO 2 with HCOOH and HNO 3 . Journal of the American Chemical Society 146 (20) (2024)
Josep M Anglada, Marilia T C Martins-Costa, Joseph S Francisco, Manuel F Ruiz-Lopez
Triplet State Radical Chemistry: Significance of the Reaction of 3 SO 2 with HCOOH and HNO 3 . Journal of the American Chemical Society (2024)
Marilia T C Martins-Costa, Manuel F Ruiz-Lopez
Reactivity of Monoethanolamine at the Air-Water Interface and Implications for CO 2 Capture. The journal of physical chemistry. B (2024)
Josep M Anglada, Marilia T C Martins-Costa, Joseph S Francisco, Manuel F Ruiz-Lopez
Triplet State Radical Chemistry: Significance of the Reaction of 3 SO 2 with HCOOH and HNO 3 . Journal of the American Chemical Society 146 (20) (2024)
Marilia T C Martins-Costa, Manuel F Ruiz-Lopez
Electrostatics and Chemical Reactivity at the Air-Water Interface. Journal of the American Chemical Society 145 (2) (2023)
Marilia T C Martins-Costa, Manuel F Ruiz-Lopez
Electrostatics and Chemical Reactivity at the Air-Water Interface. Journal of the American Chemical Society 145 (2) (2023)
Marilia T C Martins-Costa, Manuel F Ruiz-Lopez
Electrostatics and Chemical Reactivity at the Air-Water Interface. Journal of the American Chemical Society 145 (2) (2023)
Marilia T C Martins-Costa, Manuel F Ruiz-Lopez
Electrostatics and Chemical Reactivity at the Air-Water Interface. Journal of the American Chemical Society (2023)
Chu Gong, Xu Yuan, Dong Xing, Dongmei Zhang, Marilia T C Martins-Costa, Josep M Anglada, Manuel F Ruiz-Lopez, Joseph S Francisco, Xinxing Zhang
Fast Sulfate Formation Initiated by the Spin-Forbidden Excitation of SO 2 at the Air-Water Interface. Journal of the American Chemical Society 144 (48) (2022)
Marilia T C Martins-Costa, Josep M Anglada, Joseph S Francisco, Manuel F Ruiz-Lopez
Photosensitization mechanisms at the air-water interface of aqueous aerosols. Chemical science 13 (9) (2022)
Volkan Fındık, Betül Tuba Varınca Gerçik, Öykü Sinek, Safiye Sag Erdem, Manuel F Ruiz-Lopez
Mechanistic Investigation of Lysine-Targeted Covalent Inhibition of PI3Kδ via ONIOM QM:QM Computations. Journal of chemical information and modeling (2022)
Manuel F Ruiz-Lopez, Marilia T C Martins-Costa
Disentangling reaction rate acceleration in microdroplets. Physical chemistry chemical physics : PCCP (2022)
Volkan Fındık, Manuel F Ruiz-Lopez, Safiye Sag Erdem
Mechanistic insights into lysine-targeting covalent inhibition through a theoretical study of ester aminolysis. Organic & biomolecular chemistry 19 (45) (2021)
Manuel F Ruiz-Lopez, Marilia T C Martins-Costa, Joseph S Francisco, Josep M Anglada
Tight electrostatic regulation of the OH production rate from the photolysis of hydrogen peroxide adsorbed on surfaces. Proceedings of the National Academy of Sciences of the United States of America 118 (30) (2021)
Marilia T C Martins-Costa, Manuel F Ruiz-Lopez
Vibrational Sum-Frequency Generation Spectroscopy in the Energy Representation from Dual-Level Molecular Dynamics Simulations. The journal of physical chemistry. A 124 (27) (2020)
Marilia T C Martins-Costa, Josep M Anglada, Joseph S Francisco, Manuel F Ruiz-Lopez
The Aqueous Surface as an Efficient Transient Stop for the Reactivity of Gaseous NO2 in Liquid Water. Journal of the American Chemical Society 142 (50) (2020)
Josep M Anglada, Marilia T C Martins-Costa, Joseph S Francisco, Manuel F Ruiz-Lopez
Reactivity of Undissociated Molecular Nitric Acid at the Air-Water Interface. Journal of the American Chemical Society 143 (1) (2020)
Marilia T C Martins-Costa, Manuel F Ruiz-Lopez
Isoprene Reactivity on Water Surfaces from ab initio QM/MM Molecular Dynamics Simulations. Chemphyschem : a European journal of chemical physics and physical chemistry 21 (20) (2020)
Manuel F Ruiz-Lopez, Joseph S Francisco, Marilia T C Martins-Costa, Josep M Anglada
Molecular reactions at aqueous interfaces. Nature reviews. Chemistry 4 (9) (2020)
Josep M Anglada, Marilia T C Martins-Costa, Joseph S Francisco, Manuel F Ruiz-Lopez
Photoinduced Oxidation Reactions at the Air-Water Interface. Journal of the American Chemical Society 142 (38) (2020)
Manuel F Ruiz-Lopez, Marilia T C Martins-Costa, Josep M Anglada, Joseph S Francisco
A New Mechanism of Acid Rain Generation from HOSO at the Air-Water Interface. Journal of the American Chemical Society 141 (42) (2019)
Carlos Bistafa, Yukichi Kitamura, Marilia T C Martins-Costa, Masataka Nagaoka, Manuel F Ruiz-Lopez
Vibrational Spectroscopy in Solution through Perturbative ab Initio Molecular Dynamics Simulations. Journal of chemical theory and computation 15 (8) (2019)
Lorraine A Malaspina, Erna K Wieduwilt, Justin Bergmann, Florian Kleemiss, Benjamin Meyer, Manuel F Ruiz-Lopez, Rumpa Pal, Emanuel Hupf, Jens Beckmann, Ross O Piltz, Alison J Edwards, Simon Grabowsky, Alessandro Genoni
Fast and Accurate Quantum Crystallography: From Small to Large, from Light to Heavy. The journal of physical chemistry letters 10 (22) (2019)
Tarek Trabelsi, Josep M Anglada, Manuel F Ruiz-Lopez, Joseph S Francisco
Photochemistry of HOSO radical in the gas phase. The Journal of chemical physics 151 (11) (2019)
Marilia T C Martins-Costa, Josep M Anglada, Joseph S Francisco, Manuel F Ruiz-Lopez
Theoretical Investigation of the Photoexcited NO2 +H2 O reaction at the Air-Water Interface and Its Atmospheric Implications. Chemistry (Weinheim an der Bergstrasse, Germany) 25 (61) (2019)
Carlos Bistafa, Yukichi Kitamura, Marilia T C Martins-Costa, Masataka Nagaoka, Manuel F Ruiz-Lopez
Cost-Effective Method for Free-Energy Minimization in Complex Systems with Elaborated Ab Initio Potentials. Journal of chemical theory and computation 14 (6) (2018)
Marilia T C Martins-Costa, Josep M Anglada, Joseph S Francisco, Manuel F Ruiz-Lopez
Photochemistry of SO2 at the Air-Water Interface: A Source of OH and HOSO Radicals. Journal of the American Chemical Society 140 (39) (2018)
Francesca Ingrosso, Manuel F Ruiz-Lopez
Electronic Interactions in Iminophosphorane Superbase Complexes with Carbon Dioxide. The journal of physical chemistry. A 122 (6) (2018)
Marilia T C Martins-Costa, Josep M Anglada, Manuel F Ruiz-Lopez
Computational Insights into the CH3 Cl+OH Chemical Reaction Dynamics at the Air-Water Interface. Chemphyschem : a European journal of chemical physics and physical chemistry 18 (19) (2017)
Marilia T C Martins-Costa, Manuel F Ruiz-Lopez
Reaching multi-nanosecond timescales in combined QM/MM molecular dynamics simulations through parallel horsetail sampling. Journal of computational chemistry 38 (10) (2017)