[S4] S4.New Materials Science on Nanoscale Structures and Functions at Crystal Interface(1)

4:25 PM - 4:40 PM JST(7:25 AM - 7:40 AM UTC)

[S4.9] Intrinsic interface in Zintl compounds: manipulating transport properties through interfacial decoupling

*Tran Cong　Thang¹, Sekimoto Wataru¹, Fujii Susumu^2,3, Yoshiya Masato^1,3 (1. Graduate School of Engineering, The University of Osaka, 2. Japan Fine Ceramics Center, 3. Graduate School of Engineering, Kyushu University)

Keywords:

熱電材料,内的界面,第一原理計算

第一原理計算で内的界面を有する層状Zintl化合物の層構造と結合性が輸送特性に与える影響を理論的に検討し、輸送特性の独立制御が可能となる新たな設計指針を提示する