Publications by authors named "Francesco Buda"

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Sulfophenylated centimeter-sized graphene membrane in a direct methanol fuel cell.
Weizhe Zhang, Max Makurat, Xue Liu, Buhang Chen, Yanglizhi Li, Francesco Buda

Nat Commun· November 2025

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Structure over States: Planarity, Not Energy, Dictates Photoactivation in Ru(II) PACT Agents.
Matthijs L A Hakkennes, Irene Regeni, Yurii Husiev, Valeriia D Andreeva, Maxime A Siegler, Francesco Buda

J Am Chem Soc· October 2025

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Semi-empirical metadynamics simulations for chemical glycosylation reactions.
Bas Kreupeling, Daan Hoogers, Simon Chen, Pien A Meulenhoff, Wouter A Remmerswaal, Francesco Buda

J Chem Phys· October 2025

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Effects of Nuclear Motion on the Photoinduced Interfacial Charge Transfer Dynamics at a NiO/P1 Photocathode.
Titus de Haas, Kaijian Zhu, Joannes M van der Sterre, Yusen Luo, Guido Mul, Francesco Buda

J Phys Chem C Nanomater Interfaces· April 2025

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Electron-Withdrawing Effects in Cobalt Porphyrin Catalysts Boost Homogeneous Photocatalytic Hydrogen Evolution in Neutral Aqueous Solutions.
Chengyu Liu, Titus de Haas, Francesco Buda, Sylvestre Bonnet

ACS Catal· March 2025

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Conformational Dynamics of Bacteriochlorophyll in Chlorosomes from the Mutant of .
Lolita Dsouza, Karthick Babu Sai Sankar Gupta, Xinmeng Li, Vesna Erić, Yusen Luo, Francesco Buda

J Phys Chem B· February 2025

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Charge Transfer-Induced Weakening of Vibronic Coupling for Single Terrylene Molecules Adsorbed onto Hexagonal Boron Nitride.
Titus de Haas, Robert Smit, Arash Tebyani, Semonti Bhattacharyya, Kenji Watanabe, Francesco Buda

J Phys Chem Lett· January 2025

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Limiting Molecular Twisting: Upgrading a Donor-Acceptor Dye to Drive H Evolution.
Kaijian Zhu, Ainoa Paradelo Rodríguez, Maria B Brands, Titus de Haas, Francesco Buda

Adv Sci (Weinh)· October 2024

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Effect of Anchoring Dynamics on Proton-Coupled Electron Transfer in the Ru(bda) Coordination Oligomer on a Graphitic Surface.
Dario Calvani, Rick Louwersheimer, Francesco Buda

Chempluschem· August 2024

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An integrated approach towards extracting structural characteristics of chlorosomes from a mutant of .
Lolita Dsouza, Xinmeng Li, Vesna Erić, Annemarie Huijser, Thomas L C Jansen, Francesco Buda

Phys Chem Chem Phys· June 2024

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Observation of Dark States in Two-Dimensional Electronic Spectra of Chlorosomes.
Vesna Erić, Xinmeng Li, Lolita Dsouza, Annemarie Huijser, Alfred R Holzwarth, Francesco Buda

J Phys Chem B· April 2024

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Covalent Benzenesulfonic Functionalization of a Graphene Nanopore for Enhanced and Selective Proton Transport.
Dario Calvani, Bas Kreupeling, G J Agur Sevink, Huub J M de Groot, Grégory F Schneider, Francesco Buda

J Phys Chem C Nanomater Interfaces· February 2024

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MetalDock: An Open Access Docking Tool for Easy and Reproducible Docking of Metal Complexes.
Matthijs L A Hakkennes, Francesco Buda, Sylvestre Bonnet

J Chem Inf Model· December 2023

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Photon Energy-Dependent Ultrafast Exciton Transfer in Chlorosomes of and the Role of Supramolecular Dynamics.
Sean K Frehan, Lolita Dsouza, Xinmeng Li, Vesna Eríc, Thomas L C Jansen, Francesco Buda

J Phys Chem B· September 2023

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Elucidation of the Electrocatalytic Nitrite Reduction Mechanism by Bio-Inspired Copper Complexes.
Phebe H van Langevelde, Silène Engbers, Francesco Buda, Dennis G H Hetterscheid

ACS Catal· August 2023

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Ultrafast Anisotropy Decay Reveals Structure and Energy Transfer in Supramolecular Aggregates.
Vesna Erić, Jorge Luis Castro, Xinmeng Li, Lolita Dsouza, Sean K Frehan, Francesco Buda

J Phys Chem B· August 2023

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In vivo metallophilic self-assembly of a light-activated anticancer drug.
Xue-Quan Zhou, Peiyuan Wang, Vadde Ramu, Liyan Zhang, Suhua Jiang, Francesco Buda

Nat Chem· July 2023

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Correction: Automated assessment of redox potentials for dyes in dye-sensitized photoelectrochemical cells.
Jelena Belić, Arno Förster, Jan Paul Menzel, Francesco Buda, Lucas Visscher

Phys Chem Chem Phys· July 2023

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Ligand Rigidity Steers the Selectivity and Efficiency of the Photosubstitution Reaction of Strained Ruthenium Polypyridyl Complexes.
Matthijs L A Hakkennes, Michael S Meijer, Jan Paul Menzel, Anne-Charlotte Goetz, Roy Van Duijn, Francesco Buda

J Am Chem Soc· June 2023

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Manifestation of Hydrogen Bonding and Exciton Delocalization on the Absorption and Two-Dimensional Electronic Spectra of Chlorosomes.
Vesna Erić, Xinmeng Li, Lolita Dsouza, Sean K Frehan, Annemarie Huijser, Francesco Buda

J Phys Chem B· February 2023

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Challenges in Elucidating the Free Energy Scheme of the Laccase Catalyzed Reduction of Oxygen.
Daan den Boer, Hendrik C de Heer, Francesco Buda, Dennis G H Hetterscheid

ChemCatChem· January 2023

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In Silico Optimization of Charge Separating Dyes for Solar Energy Conversion.
Jan Paul Menzel, Yorrick Boeije, Tijmen M A Bakker, Jelena Belić, Joost N H Reek, Francesco Buda

ChemSusChem· August 2022

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Freestanding non-covalent thin films of the propeller-shaped polycyclic aromatic hydrocarbon decacyclene.
Alex van der Ham, Xue Liu, Dario Calvani, Adéla Melcrová, Melania Kozdra, Francesco Buda

Nat Commun· April 2022

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Analytical Nonadiabatic Couplings and Gradients within the State-Averaged Orbital-Optimized Variational Quantum Eigensolver.
Saad Yalouz, Emiel Koridon, Bruno Senjean, Benjamin Lasorne, Francesco Buda

J Chem Theory Comput· February 2022

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The role of chirality and plastic crystallinity in the optical and mechanical properties of chlorosomes.
Xinmeng Li, Francesco Buda, Huub J M de Groot, G J Agur Sevink

iScience· January 2022

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