Publications by authors named "Philippe Jund"

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Thermal Conductivity Calculation in Organic Liquids: Application to Poly--Olefin.
Jonathan Severin, Sophie Loehlé, Philippe Jund

Molecules· January 2024

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Thermoelectric power factor of pure and doped ZnSb via DFT based defect calculations.
Alexandre Berche, Philippe Jund

Phys Chem Chem Phys· October 2019

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Fully Ab-Initio Determination of the Thermoelectric Properties of Half-Heusler NiTiSn: Crucial Role of Interstitial Ni Defects.
Alexandre Berche, Philippe Jund

Materials (Basel)· May 2018

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Thermal conductivity calculation in anisotropic crystals by molecular dynamics: Application to α-FeO.
Jonathan Severin, Philippe Jund

J Chem Phys· February 2017

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Lattice stability and formation energies of intrinsic defects in Mg2Si and Mg2Ge via first principles simulations.
Philippe Jund, Romain Viennois, Catherine Colinet, Gilles Hug, Mathieu Fèvre

J Phys Condens Matter· January 2013

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Physical properties of thallium-tellurium based thermoelectric compounds using first-principles simulations.
Xiaoma Tao, Philippe Jund, Romain Viennois, Jean-Claude Tédenac

J Phys Chem A· August 2011

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Sodium diffusion through amorphous silica surfaces: a molecular dynamics study.
Michaël Rarivomanantsoa, Philippe Jund, Rémi Jullien

J Chem Phys· March 2004

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