activity
19962021
most citedOn the physisorption of water on graphene: a CCSD(T) study

207 citations · 940 across the 27 of their papers we have counts for

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Showing cond-mat.mtrl-sciShow all

20 papers · 1 filter

cond-mat.mtrl-sci2021★ 4 cited

Graphene Layer Morphology as an Indicator of the Metals Alloy Formation at the Interface

Elena Voloshina, Beate Paulus, Yuriy Dedkov

The intercalation of different species in graphene-metal interfaces is widely used to stabilise the artificial phases of different materials. However, formation of the surface allo…

cond-mat.mtrl-sci2021★ 1 cited

Modification of the magnetic and electronic properties of the graphene-Ni(111) interface via halogens intercalation

Yong Zhou, Roman Ovcharenko, Beate Paulus +2

Electronic decoupling of graphene from metallic and semiconducting substrates via intercalation of different species is one of the widely used approaches in studies of graphene. In…

cond-mat.mtrl-sci2019★ 4 cited

Electronic structure and magnetic properties of the graphene/Ni3Mn/Ni(111) trilayer

Elena Voloshina, Qilin Guo, Beate Paulus +6

Experimental and theoretical studies of manganese deposition on graphene/Ni(111) shows that a thin ferromagnetic Ni3Mn layer, which is protected by the graphene overlayer, is forme…

cond-mat.mtrl-sci2018★ 36 cited

The graphene/n-Ge(110) interface: structure, doping, and electronic properties

Julia Tesch, Fabian Paschke, Mikhail Fonin +10

The implementation of graphene in semiconducting technology requires the precise knowledge about the graphene-semiconductor interface. In our work the structure and electronic prop…

cond-mat.mtrl-sci2017

Cyanographone and Isocyanographone two asymmetrically functionalized graphene pseudohalides and their potential use in chemical sensing

Lukas Eugen Marsoner Steinkasserer, Vincent Pohl, Beate Paulus

Graphene pseudohalides are natural candidates for use in molecular sensing due to their greater chemical activity as compared to both graphene halides and pristine graphene. Though…

cond-mat.mtrl-sci2016★ 14 cited

Gap control in phosphorene/BN structures from first principles calculations

Lukas Eugen Marsoner Steinkasserer, Simon Suhr, Beate Paulus

Using both DFT as well as calculations, we investigate static and dynamic effects on the phosphorene band gap upon deposition and encapsulation on/in BN multilayers. We de…