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Physical Chemistry Chemical Physics : PCCP|August 29, 2019
New insights into the origin of unstable sodium graphite intercalation compoundsOlena Lenchuk, Philipp Adelhelm, Doreen Mollenhauer
Journal of Computational Chemistry|June 30, 2019
Comparative study of density functionals for the description of lithium-graphite intercalation compoundsOlena Lenchuk, Philipp Adelhelm, Doreen Mollenhauer
Angewandte Chemie (International Ed. in English)|April 26, 2018
Editorial: The Energy Challenge, Batteries, and Why Simple Math MattersPhilipp Adelhelm
Journal of Computational Chemistry|March 21, 2014
A balanced procedure for the treatment of cluster-ligand interactions on gold phosphine systems in catalysisDoreen Mollenhauer, Nicola Gaston
Physical Chemistry Chemical Physics : PCCP|October 7, 2016
Phosphine passivated gold clusters: how charge transfer affects electronic structure and stabilityDoreen Mollenhauer, Nicola Gaston
Physical Chemistry Chemical Physics : PCCP|September 30, 2021
Influence of the PO<sub></sub>N<sub>4-</sub> structural units on the formation energies and transport properties of lithium phosphorus oxynitride: a DFT studyPascal Henkel, Jürgen Janek, Doreen Mollenhauer
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry|August 24, 2016
Charge Spreading in Deep Eutectic SolventsStefan Zahn, Barbara Kirchner, Doreen Mollenhauer
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