Publications related to Data-powered augmented volcano plots for homogeneous catalysis

Related publications (6)

Interpreting chemisorption strength with AutoML-based feature deletion experiments

The chemisorption energy of reactants on a catalyst surface, Eads, is among the most informative characteristics of understanding and pinpointing the optimal catalyst. The intrinsic complexity of catalyst surfaces and chemisorption reactions presents signi ...

National Academy of Sciences2024

Decreasing the Stability of Borohydride with Ionic Liquids for Hydrogen Storage and Carbon Dioxide Conversion

Loris Giovanni Lombardo

The world needs to move from a fossil fuel to a renewable energy based society. With the increasing electricity production from wind and PV, short and long term energy storage are becoming one of challenge of the 21st century. While batteries are the prefe ...

EPFL2021

Ni3N as an Active Hydrogen Oxidation Reaction Catalyst in Alkaline Medium

Xile Hu, Andreas Schueler, Josef Andreas Schuler, Anna Krammer, Weiyan Ni

Hydroxide-exchange membrane fuel cells can potentially utilize platinum-group-metal (PGM)-free electrocatalysts, offering cost and scalability advantages over more developed proton-exchange membrane fuel cells. However, there is a lack of non-precious elec ...

Wiley-VCH Verlag GmbH2019

On the Generality of Molecular Volcano Plots

Anne-Clémence Corminboeuf, Matthew Wodrich, Boodsarin Sawatlon, Michael Markus Busch

In homogeneous catalysis, the structure and electronic config-uration of the active catalysts can vary significantly. Changes inligation, oxidation, and spin states have the potential to influ-ence the catalytic cycle energet ics strongly that, to a larged ...

Wiley-VCH Verlag2018

Advanced characterization methods for self-assembled organization on nanoparticles

Zhi Luo

The complex organizations of amino acid residues on protein surfaces give rise to a wide space of functions for proteins. Great efforts are devoted in biology to understand such structure-property relationships. Many advanced characterization techniques ha ...

EPFL2018

Ni-based structured catalyst for selective 3-phase hydrogenation of nitroaromatics

Paul Joseph Dyson, Lioubov Kiwi, Thomas La Grange, Daniel André Samuel Lamey, Oliver Anthony Beswick

We report herein on the development of Ni-based catalyst using activated carbon fibres (ACFs) as a structured support and its application for the three‐phase hydrogenation of nitroarenes (T = 353 K; P = 10 bar). It was shown that metallic Ni0 nanoparticles ...

Elsevier2016