Simulation of crystal and electronic structures of octahedral molybdenum cluster complex compound Cs2[Mo6Cl14] using various DFT functionals-Reference-Cited by-同舟云学术

Simulation of crystal and electronic structures of octahedral molybdenum cluster complex compound Cs₂[Mo₆Cl₁₄] using various DFT functionals

Author:

SAITO Norio¹²³,LEMOINE Pierric⁴,CORDIER Stéphane⁴,OHSAWA Takeo²⁵,WADA Yoshiki²³,GRASSET Fabien²⁵³,CROSS Jeffrey Scott¹,OHASHI Naoki²⁵³⁶

Affiliation:

1. Department of Metallurgy and Ceramics Science, Tokyo Institute of Technology

2. National Institute for Materials Science

3. Laboratory for Innovative Key Materials and Structures, Unité Mixte Internationale 3629, National Institute for Materials Science

4. Institut des Sciences Chimiques de Rennes, Unités Mixtes de Recherché 6226, University of Rennes 1

5. NIMS-Saint-Gobain Center of Excellence for Advanced Materials, National Institute for Materials Science

6. Materials Research Center for Element Strategy, Tokyo Institute of Technology

Publisher

Ceramic Society of Japan

Subject

Materials Chemistry,Condensed Matter Physics,General Chemistry,Ceramics and Composites

Link

Reference64 articles.

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