Art

J-GLOBAL ID：201602284605539687   Reference number：16A1395267

Theoretical study of lithium ionic conductors by electronic stress tensor density and electronic kinetic energy density

電子の応力テンソル密度と電子運動エネルギー密度によるリチウムイオン伝導体の理論的研究

Author (6)： Nozaki Hiroo (Department of Micro Engineering, Kyoto University, Bldg. C3, Kyotodaigakukatsura, Nishikyo-Ku, Kyoto-Shi, Kyoto, 615-8540, Japan) ,  Fujii Yosuke (Department of Micro Engineering, Kyoto University, Bldg. C3, Kyotodaigakukatsura, Nishikyo-Ku, Kyoto-Shi, Kyoto, 615-8540, Japan) ,  Ichikawa Kazuhide (Department of Micro Engineering, Kyoto University, Bldg. C3, Kyotodaigakukatsura, Nishikyo-Ku, Kyoto-Shi, Kyoto, 615-8540, Japan) ,  Watanabe Taku (AR Center, Samsung R&D Institute Japan, Minoh Semba Center Bldg, Semba Nishi 2-1-11, Minoh, Osaka, 562-0036, Japan) ,  Aihara Yuichi (AR Center, Samsung R&D Institute Japan, Minoh Semba Center Bldg, Semba Nishi 2-1-11, Minoh, Osaka, 562-0036, Japan) ,  Tachibana Akitomo (Department of Micro Engineering, Kyoto University, Bldg. C3, Kyotodaigakukatsura, Nishikyo-Ku, Kyoto-Shi, Kyoto, 615-8540, Japan)
Material： Journal of Computational Chemistry  (J Comput Chem)
Volume： 37  Issue： 20  Page： 1924-1934  Publication year： Jul. 30, 2016 
JST Material Number： C0111B  ISSN： 0192-8651  CODEN： JCCHDD  Document type： Article
Article type： 原著論文  Country of issue： United States (USA)  Language： ENGLISH (EN)

Thesaurus term： *conductor ,  *lithium compound ,  *metal ion ,  ionic bond ,  *stress tensor ,  *kinetic energy ,  phosphorus compound ,  phosphorus sulfide ,  phosphorus oxide ,  electronic structure ,  energy density ,  metalloid ,  *energy ,  *ion conductor ,  *lithium ion ,  *electron energy ,  *mechanical quantity

Author keywords (5)： wave function analysis ,  theory of chemical bond ,  stress tensor density ,  kinetic energy density ,  lithium ionic conductor

JST classification (3)： Electronic structure of crystalline metals  (BM02050C) ,  Electric conduction in other inorganic compounds  (BM03044O) ,  Other physical chemistry in general  (CB01030T)

Terms in the title (7)： 電子 ,  応力 ,  密度 ,  リチウム ,  イオン伝導体 ,  理論 ,  研究