activity
20092020
most citedMolecular adsorption in graphene with divacancy defects

170 citations · 973 across the 15 of their papers we have counts for

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Showing cond-mat.mtrl-sciShow all

13 papers · 1 filter

cond-mat.mtrl-sci2020

Interstitial Carbon in bcc HfNbTiVZr high entropy alloy from first principles

Luis Casillas-Trujillo, Ulf Jansson, Martin Sahlberg +6

The remarkable mechanical properties of high entropy alloys can be further improved by interstitial alloying. In this work we employ density functional theory calculations to study…

cond-mat.mtrl-sci2018★ 21 cited

Magnetic and mechanical effects of Mn substitutions in AlFe2B2

Johan Cedervall, Mikael S. Andersson, Diana Iusan +4

The mechanical and magnetic properties of the newly discovered MAB-phase class of materials based upon AlFe2B2 were investigated. The samples were synthesised from stoichiometric a…

cond-mat.mtrl-sci2016★ 98 cited

AlM2B2 (M=Cr, Mn, Fe, Co, Ni): a group of nanolaminated materials

Krisztina Kadas, Diana Iusan, Johan Hellsvik +5

Combining theory with experiments, we study the phase stability, elastic properties, electronic structure and hardness of layered ternary borides AlCr2B2, AlMn2B2, AlFe2B2, AlCo2B2…

cond-mat.mtrl-sci2015★ 121 cited

Structure and bonding in amorphous iron carbide thin films

Andrej Furlan, Ulf Jansson, Jun Lu +2

We investigate the amorphous structure, chemical bonding, and electrical properties of magnetron sputtered Fe1-xCx (0.21<x<0.72) thin films. X-ray, electron diffraction and transmi…

cond-mat.mtrl-sci2014★ 139 cited

Crystallization characteristics and chemical bonding properties of nickel carbide thin film nanocomposites

Andrej Furlan, Jun Lu, Lars Hultman +2

The crystal structure and chemical bonding of magnetron-sputtering deposited nickel carbide NiC (0.05x0.62) thin films have been investigated by high-reso…

cond-mat.mtrl-sci2013★ 3 cited

A first principles study of the stability and mobility of defects in titanium carbide

Mikael Råsander, Biplab Sanyal, Ulf Jansson +1

We have performed density functional calculations of the formation energies of substitutional transition metal (TM) defects, C vacancies, and C interstitial defects in TiC. In addi…