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Physical Chemistry

Working Paper

Coupling of photoactive transition metal complexes to a functional polymer matrix

Miftahussurur Hamidi Putra, Sebastian Seidenath, Stephan Kupfer, Stefanie Gräfe, Axel Gross

Version 1 posted 02 August 2021

123

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Energy

Working Paper

Unraveling propylene oxide formation in alkali metal batteries

Daniel Stottmeister, Leonie Wildersinn, Julia Maibach, Andreas Hofmann, Fabian Jeschull, Axel Gross

Version 1 posted 10 July 2023

137

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Energy

Working Paper

Initial steps in the formation of the solid electrolyte interphase on alkaline metal anodes studied by ab initio simulations

Daniel Stottmeister, Axel Gross

Version 1 posted 06 April 2023

180

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Materials Chemistry

Review

Ion mobility in crystalline battery materials

Mohsen Sotoudeh, Sebastian Baumgart, Manuel Dillenz, Johannes Döhn, Katrin Forster-Tonigold, Katharina Helmbrecht, Daniel Stottmeister, Axel Groß

Version 1 posted 03 August 2023

485

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Theoretical and Computational Chemistry

Working Paper

Prediction of strong solvatochromism in a molecular photocatalyst

Miftahussurur Hamidi Putra, Benedikt Bagemihl, Sven Rau, Axel Gross

Version 1 posted 12 January 2023

172

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Energy

Working Paper

Computational Screening of Oxide Perovskites as Insertion-Type Cathode Material

Johannes Döhn, Axel Gross

Version 1 posted 21 September 2023

142

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1

Citations

Materials Chemistry

Review

Computational screening and descriptors for the ion mobility in energy storage materials

Mohsen Sotoudeh, Axel Gross

Version 1 posted 06 February 2024

146

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Theoretical and Computational Chemistry

Working Paper

Composition and electronic structure of Mn3O4 and Co3O4 cathodes in zinc/air batteries: a DFT study

Fernanda Juarez, Hui Yin, Axel Gross

Version 1 posted 18 November 2021

279

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Theoretical and Computational Chemistry

Working Paper

Hot atom chemistry: oxygen at stepped platinum surfaces

Axel Gross

Version 1 posted 29 December 2021

171

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Theoretical and Computational Chemistry

Working Paper

Rhombohedral (R-3) Prussian White as cathode material: An ab-initio study

Sebastian Baumgart, Mohsen Sotoudeh, Axel Groß

Version 1 posted 04 July 2023

164

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29 results in Axel Gross in Authors: Axel Gross

Coupling of photoactive transition metal complexes to a functional polymer matrix

Unraveling propylene oxide formation in alkali metal batteries

Initial steps in the formation of the solid electrolyte interphase on alkaline metal anodes studied by ab initio simulations

Ion mobility in crystalline battery materials

Prediction of strong solvatochromism in a molecular photocatalyst

Computational Screening of Oxide Perovskites as Insertion-Type Cathode Material

Computational screening and descriptors for the ion mobility in energy storage materials

Composition and electronic structure of Mn3O4 and Co3O4 cathodes in zinc/air batteries: a DFT study

Hot atom chemistry: oxygen at stepped platinum surfaces

Rhombohedral (R-3) Prussian White as cathode material: An ab-initio study

29 results in Authors: Axel Gross