Art

J-GLOBAL ID：201102222517510176   Reference number：11A1020235

Surface reduction processes of cerium oxide surfaces by H₂ using ultra accelerated quantum chemical molecular dynamic study

超促進した量子化学の分子動力学研究を用いたH₂による酸化セリウム表面の表面還元工程

Author (12)： ALAM Md. Korshed (Dep. of Chemical Engineering, Graduate School of Engineering, Tohoku Univ., 6-6-10-205 Aoba, Aramaki, Aoba-ku ...) ,  AHMED Farouq (Dep. of Applied Chemistry, Graduate School of Engineering, Tohoku Univ., 6-6-10-205 Aoba, Aramaki, Aoba-ku, Sendai ...) ,  MIURA Ryuji (Dep. of Applied Chemistry, Graduate School of Engineering, Tohoku Univ., 6-6-10-205 Aoba, Aramaki, Aoba-ku, Sendai ...) ,  SUZUKI Ai (New Ind. Creation Hatchery Center, Tohoku Univ., 6-6-10-205 Aoba, Aramaki, Aoba-ku, Sendai 980-8579, JPN) ,  TSUBOI Hideyuki (Dep. of Applied Chemistry, Graduate School of Engineering, Tohoku Univ., 6-6-10-205 Aoba, Aramaki, Aoba-ku, Sendai ...) ,  HATAKEYAMA Nozomu (Dep. of Applied Chemistry, Graduate School of Engineering, Tohoku Univ., 6-6-10-205 Aoba, Aramaki, Aoba-ku, Sendai ...) ,  ENDOU Akira (Dep. of Applied Chemistry, Graduate School of Engineering, Tohoku Univ., 6-6-10-205 Aoba, Aramaki, Aoba-ku, Sendai ...) ,  TAKABA Hiromitsu (Dep. of Chemical Engineering, Graduate School of Engineering, Tohoku Univ., 6-6-10-205 Aoba, Aramaki, Aoba-ku ...) ,  KUBO Momoji (Fracture and Reliability Res. Inst., Graduate School of Engineering, Tohoku Univ., 6-6-11-701 Aoba, Sendai 980-8579, JPN) ,  MIYAMOTO Akira (Dep. of Chemical Engineering, Graduate School of Engineering, Tohoku Univ., 6-6-10-205 Aoba, Aramaki, Aoba-ku ...) ,  MIYAMOTO Akira (Dep. of Applied Chemistry, Graduate School of Engineering, Tohoku Univ., 6-6-10-205 Aoba, Aramaki, Aoba-ku, Sendai ...) ,  MIYAMOTO Akira (New Ind. Creation Hatchery Center, Tohoku Univ., 6-6-10-205 Aoba, Aramaki, Aoba-ku, Sendai 980-8579, JPN)
Material： Catalysis Today  (Catal Today)
Volume： 164  Issue： 1  Page： 9-15  Publication year： Apr. 30, 2011 
JST Material Number： T0363A  ISSN： 0920-5861  Document type： Article
Article type： 原著論文  Country of issue： Netherlands (NLD)  Language： ENGLISH (EN)

Thesaurus term： *cerium oxide ,  *molecular dynamics ,  quantum theory ,  *hydrogen ,  *surface reaction ,  *reduction(reaction) ,  catalyst preparation ,  first principle ,  computer simulation ,  *reaction mechanism ,  adsorption
Semi thesaurus term： Molecular Dynamics Simulation ,  *quantum molecular dynamics

JST classification (2)： Other catalysts  (CB06123Z) ,  Electron theory of adsorption  (CB12042Y)

Terms in the title (7)： 促進 ,  量子化学 ,  分子動力学 ,  研究 ,  H2 ,  酸化セリウム ,  還元