Exchange-correlation and spin-orbit coupling effects in 18-electrons transparent conductors half-Heusler: Ab-initio study

Author:

Mellah Djallal Eddine,Demmouche KamelORCID

Publisher

Elsevier BV

Subject

Materials Chemistry,Condensed Matter Physics,Materials Science (miscellaneous),Electronic, Optical and Magnetic Materials

Reference38 articles.

1. Prediction and accelerated laboratory discovery of previously unknown 18-electron ABX compounds;Romain;Nature Chem.,2015

2. Design and discovery of a novel half-Heusler transparent hole conductor made of all-metallic heavy elements;Feng;Nature Commun.,2015

3. A valence balanced rule for discovery of 18-electron half-Heuslers with defects;Anand;Energy Environ. Sci.,2018

4. Structural stability, electronic structure, and novel transport properties with high thermoelectric performances of ZrIrX (X=As, Bi, and Sb);Yassine;J. Electron. Mater.,2017

5. Ab initio prediction of the structural, electronic, elastic, and thermoelectric properties of half-Heusler ternary compounds TiIrX (X=As and Sb);Chibani;J. Electron. Mater.,2018

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