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The Journal of Chemical Physics|August 20, 2014
Dispersion corrected RPBE studies of liquid waterKatrin Forster-Tonigold, Axel Groß
Journal of the American Chemical Society|February 16, 2019
Toward an Atomic-Scale Understanding of Electrochemical Interface Structure and DynamicsOlaf M Magnussen, Axel Groß
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry|May 29, 2014
Polar surface energies of iono-covalent materials: implications of a charge-transfer model tested on Li2FeSiO4 surfacesNicolas G Hörmann, Axel Groß
The Journal of Chemical Physics|June 28, 2013
Comparison of density functionals for nitrogen impurities in ZnOSung Sakong, Johann Gutjahr, Peter Kratzer
Physical Chemistry Chemical Physics : PCCP|May 10, 2007
CO adsorption on Cu-Pd alloy surfaces: ligand versus ensemble effectsSung Sakong, Christian Mosch, Axel Gross
Nano Letters|January 25, 2012
Catalytic role of gold nanoparticle in GaAs nanowire growth: a density functional theory studyPeter Kratzer, Sung Sakong, Volker Pankoke
Nanotechnology|March 18, 2014
Interplay of hydrogen treatment and nitrogen doping in ZnO nanoparticles: a first-principles studyJohann Gutjahr, Sung Sakong, Peter Kratzer
ACS Physical Chemistry Au|July 29, 2025
Data-Driven Site Occupancy Statistics in Cubic Prussian BlueSebastian Baumgart, Axel Groß, Mohsen Sotoudeh
Beilstein Journal of Nanotechnology|June 24, 2016
First-principles study of the structure of water layers on flat and stepped Pb electrodesXiaohang Lin, Ferdinand Evers, Axel Groß
Frontiers in Chemistry|August 28, 2020
Sulfate, Bisulfate, and Hydrogen Co-adsorption on Pt(111) and Au(111) in an Electrochemical EnvironmentFlorian Gossenberger, Fernanda Juarez, Axel Groß
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