Ralph Gebauer
6PUBLICATIONS
13CO-AUTHORS
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Publications (6)
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|Aug 13, 2025
Acid-Base Chemistry of Short Hydrogen Bonds: A Tale of Schrödinger's Cat in Glutamine-Derived Crystals.Muhammad Nawaz Qaisrani, Nandha Kumar, Christian Dreßler
|Apr 18, 2024
Exploring the Mechanisms behind Non-aromatic Fluorescence with the Density Functional Tight Binding Method.Gonzalo Díaz Mirón, Carlos R Lien-Medrano, Debarshi Banerjee
|Feb 19, 2024
How spin state and oxidation number of transition metal atoms determine molecular adsorption: a first-principles case study for NH<sub>3</sub>.Hua-Jian Tan, Rutong Si, Xi-Bo Li
|Jan 22, 2024
The Role of Water Molecules on Polaron Behavior at Rutile (110) Surface: A Constrained Density Functional Theory Study.Yun-Bo Li, Rutong Si, Bo Wen
|Jan 18, 2024
Biaxial compressive strain enhances calcium binding and mobility on two-dimensional Sc<sub>2</sub>C: a density functional theory investigation.Darwin B Putungan, Christian Loer T Llemit, Alexandra B Santos-Putungan
|Jul 14, 2023
The Oxygen Evolution Reaction at MoS<sub>2</sub> Edge Sites: The Role of a Solvent Environment in DFT-Based Molecular Simulations.Estefania German, Ralph Gebauer
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Frequent Collaborators
2 joint publications
Xiao-Lin Wei
2 joint publications
Wen-Jin Yin
2 joint publications
Ali Hassanali
1 joint publications
Estefania German
1 joint publications
Darwin B Putungan
1 joint publications
Bo Wen
1 joint publications
Nicola Seriani
1 joint publications
Zhen-Kun Tang
1 joint publications
Gonzalo Díaz Mirón
1 joint publications
Carlos R Lien-Medrano
