Axel Gross
Axel Gross
Institute of Theoretical Chemistry, Ulm University, and Helmholtz-Institute Ulm- Electrochemical
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Cited by
Cited by
Theoretical surface science
A Gross
A Microscopic Perspective. Originally published in the series: Advanced …, 2003
Six-Dimensional Quantum Dynamics of Adsorption and Desorption of at Pd(100): Steering and Steric Effects
A Gross, S Wilke, M Scheffler
Physical review letters 75 (14), 2718, 1995
Reactions at surfaces studied by ab initio dynamics calculations
A Groß
Surface science reports 32 (8), 291-340, 1998
Surface strain versus substrate interaction in heteroepitaxial metal layers: Pt on Ru (0001)
A Schlapka, M Lischka, A Groß, U Käsberger, P Jakob
Physical Review Letters 91 (1), 016101, 2003
Representing high-dimensional potential-energy surfaces for reactions at surfaces by neural networks
S Lorenz, A Groß, M Scheffler
Chemical Physics Letters 395 (4-6), 210-215, 2004
Properties of metal–water interfaces studied from first principles
S Schnur, A Groß
New Journal of Physics 11 (12), 125003, 2009
Experimental analysis of charge redistribution due to chemical bonding by high-resolution transmission electron microscopy
JC Meyer, S Kurasch, HJ Park, V Skakalova, D Künzel, A Groß, A Chuvilin, ...
Nature materials 10 (3), 209-215, 2011
Microscopic properties of lithium, sodium, and magnesium battery anode materials related to possible dendrite growth
M Jäckle, A Groß
The Journal of chemical physics 141 (17), 174710, 2014
Adsorption of small aromatic molecules on the (111) surfaces of noble metals: A density functional theory study with semiempirical corrections for dispersion effects
K Tonigold, A Groß
The Journal of chemical physics 132 (22), 224701, 2010
Reactivity of bimetallic systems studied from first principles
A Groß
Topics in Catalysis 37, 29-39, 2006
Self-diffusion barriers: possible descriptors for dendrite growth in batteries?
M Jäckle, K Helmbrecht, M Smits, D Stottmeister, A Groß
Energy & Environmental Science 11 (12), 3400-3407, 2018
Fluoride ion batteries: Theoretical performance, safety, toxicity, and a combinatorial screening of new electrodes
F Gschwind, G Rodriguez-Garcia, DJS Sandbeck, A Gross, M Weil, ...
Journal of Fluorine Chemistry 182, 76-90, 2016
Ab initio quantum and molecular dynamics of the dissociative adsorption of hydrogen on Pd(100)
A Gross, M Scheffler
Physical Review B 57 (4), 2493, 1998
Toward an atomic-scale understanding of electrochemical interface structure and dynamics
OM Magnussen, A Groß
Journal of the American Chemical Society 141 (12), 4777-4790, 2019
Dissociative adsorption of hydrogen on strained Cu surfaces
S Sakong, A Groß
Surface science 525 (1-3), 107-118, 2003
Quantum theory of dissociative chemisorption on metal surfaces
GJ Kroes, A Gross, EJ Baerends, M Scheffler, DA McCormack
Accounts of chemical research 35 (3), 193-200, 2002
High-dimensional quantum dynamics of adsorption and desorption of H 2 at Cu (111)
A Gross, B Hammer, M Scheffler, W Brenig
Physical review letters 73 (23), 3121, 1994
Local reactivity of metal overlayers: Density functional theory calculations of Pd on Au
A Roudgar, A Groß
Physical Review B 67 (3), 033409, 2003
Challenges in the first-principles description of reactions in electrocatalysis
S Schnur, A Groß
Catalysis today 165 (1), 129-137, 2011
Local reactivity of thin Pd overlayers on Au single crystals
A Roudgar, A Groß
Journal of Electroanalytical Chemistry 548, 121-130, 2003
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