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First-principles Prediction of Energy Band Gaps in 18-Valence Electron Semiconducting Half-Heusler Compounds: Exploring the Role of Exchange and Correlation

Emel Gurbuz,Murat Tas,Ersoy Sasioglu,Ingrid Mertig,Biplab Sanyal,Iosif Galanakis

JOURNAL OF APPLIED PHYSICS（2023）

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Key words
Semilocal Exchange-Correlation Potential
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