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Andreas Thore

Linköping University

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Publication

Featured researches published by Andreas Thore.

Journal of Applied Physics | 2014

First-principles calculations of the electronic, vibrational, and elastic properties of the magnetic laminate Mn2GaC

Andreas Thore; Martin Dahlqvist; Björn Alling; Johanna Rosén

In this paper, we report the by first-principles predicted properties of the recently discovered magnetic MAX phase Mn2GaC. The electronic band structure and vibrational dispersion relation, as wel ...

Physical Chemistry Chemical Physics | 2016

Phase stability of the nanolaminates V2Ga2C and (Mo1−xVx)2Ga2C from first-principles calculations

Andreas Thore; Martin Dahlqvist; Björn Alling; Johanna Rosén

We here use first-principles calculations to investigate the phase stability of the hypothetical laminated material V2Ga2C and the related alloy (Mo1–xVx)2Ga2C, the latter for a potential parent material for synthesis of (Mo1–xVx)2C, a new two-dimensional material in the family of so called MXenes.

Physical Review B | 2016

Magnetically driven anisotropic structural changes in the atomic laminate Mn2GaC

Martin Dahlqvist; Arni Sigurdur Ingason; Björn Alling; Fridrik Magnus; Andreas Thore; Andrejs Petruhins; Aurelija Mockuté; Unnar B. Arnalds; M. Sahlberg; Björgvin Hjörvarsson; Igor A. Abrikosov; Johanna Rosén

Computational Materials Science | 2014

Temperature dependent phase stability of nanolaminated ternaries from first-principles calculations

Andreas Thore; Martin Dahlqvist; Björn Alling; Johanna Rosén

Journal of Raman Spectroscopy | 2017

First‐order Raman scattering in three‐layered Mo‐based ternaries: MoAlB, Mo2Ga2C and Mo2GaC

O. Chaix-Pluchery; Andreas Thore; Sankalp Kota; Joseph Halim; Chunfeng Hu; Johanna Rosén; Thierry Ouisse; Michel W. Barsoum

Physical Review B | 2016

Magnetic exchange interactions and critical temperature of the nanolaminate Mn2GaC from first-principles supercell methods

Andreas Thore; Martin Dahlqvist; Björn Alling; Johanna Rosén

Physical Chemistry Chemical Physics | 2017

An investigation of the in-plane chemically ordered atomic laminates (Mo2/3Sc1/3)2AlC and (Mo2/3Y1/3)2AlC from first principles

Andreas Thore; Johanna Rosén

Crystal Growth & Design | 2017

Theoretical and Experimental Exploration of a Novel In-Plane Chemically Ordered (Cr2/3M1/3)2AlC i-MAX Phase with M = Sc and Y

Jun Lu; Andreas Thore; Rahele Meshkian; Quanzheng Tao; Lars Hultman; Johanna Rosén

Journal of Physics: Condensed Matter | 2018

Electronic structure, bonding characteristics, and mechanical properties in (W2/3Sc1/3)2AlC and (W2/3Y1/3)2AlC i-MAX phases from first-principles calculations

Martin Dahlqvist; Andreas Thore; Johanna Rosén

Archive | 2016

Phase stability of the nanonlaminates V2Ga2C and (Mo1-xVx)2Ga2C from first-principles calculations

Andreas Thore; Martin Dahlqvist; Björn Alling; Johanna Rosén

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Johanna Rosén

Linköping University

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Martin Dahlqvist

Linköping University

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Björn Alling

Linköping University

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Andrejs Petruhins

Linköping University

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Aurelija Mockuté

Linköping University

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Björgvin Hjörvarsson

Royal Institute of Technology

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Fridrik Magnus

Uppsala University

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Rahele Meshkian

Linköping University

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Arni Sigurdur Ingason

Linköping University

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Igor A. Abrikosov

Linköping University

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