Publikationen von Karsten Reuter
Alle Typen
Zeitschriftenartikel (318)
21.
Zeitschriftenartikel
130 (15), 156901 (2023)
Ångstrom-Depth Resolution with Chemical Specificity at the Liquid-Vapor Interface. Physical Review Letters 22.
Zeitschriftenartikel
13 (9), S. 5780 - 5786 (2023)
Electroreduction of CO2 in a Non-aqueous Electrolyte-The Generic Role of Acetonitrile. ACS Catalysis 23.
Zeitschriftenartikel
6 (2), S. 112 - 121 (2023)
Exploring catalytic reaction networks with machine learning. Nature Catalysis 24.
Zeitschriftenartikel
9 (36), 2204684 (2022)
Graphene at Liquid Copper Catalysts: Atomic-Scale Agreement of Experimental and First-Principles Adsorption Height. Advanced Science 25.
Zeitschriftenartikel
13, 7504 (2022)
Green synthesis of propylene oxide directly from propane. Nature Communications 26.
Zeitschriftenartikel
7 (12), S. 991 - 1009 (2022)
Human- and machine-centred designs of molecules and materials for sustainability and decarbonization. Nature Reviews Materials 27.
Zeitschriftenartikel
34 (21), S. 9455 - 9467 (2022)
Assessing Deep Generative Models in Chemical Composition Space. Chemistry of Materials 28.
Zeitschriftenartikel
14 (19), e202200300 (2022)
Sr Surface Enrichment in Solid Oxide Cells – Approaching the Limits of EDX Analysis by Multivariate Statistical Analysis and Simulations. ChemCatChem 29.
Zeitschriftenartikel
12 (17), 2950 (2022)
Tackling Structural Complexity in Li2 S-P2S5 Solid-State Electrolytes Using Machine Learning Potentials. Nanomaterials 30.
Zeitschriftenartikel
126 (33), S. 14116 - 14124 (2022)
Graphene as an Adsorption Template for Studying Double Bond Activation in Catalysis. The Journal of Physical Chemistry C 31.
Zeitschriftenartikel
12 (17), 2912 (2022)
Exploiting Nanoscale Complexion in LATP Solid-State Electrolyte via Interfacial Mg2+ Doping. Nanomaterials 32.
Zeitschriftenartikel
12 (16), S. 10506 - 10513 (2022)
Ab Initio Thermodynamic Stability of Carbide Catalysts under Electrochemical Conditions. ACS Catalysis 33.
Zeitschriftenartikel
2 (7), S. 443 - 450 (2022)
Predicting binding motifs of complex adsorbates using machine learning with a physics-inspired graph representation. Nature Computational Science 34.
Zeitschriftenartikel
18 (7), S. 4586 - 4593 (2022)
A Hybrid Machine Learning Approach for Structure Stability Prediction in Molecular Co-crystal Screenings. Journal of Chemical Theory and Computation 35.
Zeitschriftenartikel
12 (13), S. 7907 - 7917 (2022)
Selectivity Trends and Role of Adsorbate-Adsorbate Interactions in CO Hydrogenation on Rhodium Catalysts. ACS Catalysis 36.
Zeitschriftenartikel
122 (12), S. 10777 - 10820 (2022)
Implicit Solvation Methods for Catalysis at Electrified Interfaces. Chemical Reviews 37.
Zeitschriftenartikel
12 (10), S. 6143 - 6148 (2022)
Field Effects at Protruding Defect Sites in Electrocatalysis at Metal Electrodes? ACS Catalysis 38.
Zeitschriftenartikel
15 (10), e202200015 (2022)
Epitaxial Core-Shell Oxide Nanoparticles: First-Principles Evidence for Increased Activity and Stability of Rutile Catalysts for Acidic Oxygen Evolution. ChemSusChem 39.
Zeitschriftenartikel
1 (2), S. 147 - 157 (2022)
Reorganization energies of flexible organic molecules as a challenging target for machine learning enhanced virtual screening. Digital Discovery 40.
Zeitschriftenartikel
433 (1), 134121 (2022)
A model-free sparse approximation approach to robust formal reaction kinetics. Chemical Engineering Journal