Molecular/Atomic Design of Catalytic Sites of High-Performance

高性能催化位点的分子/原子设计

• 批准号: 07242103
• 负责人: MISONO Makoto
• 金额: $ 47.42万
• 依托单位: UNIVERSITY OF TOKYO
• 依托单位国家: 日本
• 项目类别: Grant-in-Aid for Scientific Research on Priority Areas
• 财政年份: 1995
• 资助国家: 日本
• 起止时间: 1995 至 1997
• 项目状态: 已结题
• 来源: https://kaken.nii.ac.jp/en/grant/KAKENHI-PROJECT-07242103/
• 关键词: solid catalyst; material for catalyst; catalyst design; solid state reaction field; environmental catalyst; unique reaction field; design of active site; molecular dynamics; 触媒; 触媒表面; 液相有機合成; 層状構造の強酸; 吸着反応性; 構造の要因; 構造元素の役割

The purpose of A01 group was to design active centers for the unique reaction field at atomic/molecular levels, taking into account the clear descriptions of the active centers and actual conditions of environmental catalysis. Successful achievements have been obtained in (1) the fields of heteropolyacids catalysts for molecular design and the application, (2) surface science and theoretical chemistry as tools for catalyst design and (3) model reactions for the proposal of unique reaction fields and the indentification.

A01组的目的是在原子/分子水平上为独特的反应场设计活性中心，同时考虑到活性中心的明确描述和环境催化的实际情况。在杂多酸催化剂的分子设计和应用、表面科学和理论化学作为催化剂设计的工具和模型反应的提出和鉴定等方面取得了成功的成果。

项目成果

Y.Izumi: "Hydration/Hydrolysis by solid Acids" Catal.Today. 33. 371 (1997)

Y.Izumi：“固体酸的水合/水解”Catal.Today。

T. Ito, et al.: "Structure of Porous Aggregates of the Ammonium Salt of Dodecatungstophosphoric Acid, (NHィイD24ィエD2)ィイD23ィエD2PWィイD212ィエD2WィイD240ィエD2 : Unidirectionally Oriented Self-Assembly of Nanocrystalites"J. Phys. Chem B. 101. 9958-9963 (1997)

T. Ito 等人：“十二钨磷酸铵盐的多孔聚集体的结构，(NHD24D2)D23D2PWD212D2WD240D2：纳米晶体的单向自组装”J. Phys. 101. 9958-9963 (1997)

N. Kakuta, et al: "Preparation of spherical and porous SiO_2 particles by fume pyrolysis" Preparation of Catalysts. VI. 319-326 (1995)

N. Kakuta等人：“通过烟气热解制备球形和多孔SiO_2颗粒”催化剂的制备。

T.Ito, et.al.: "Structure of Porous Aggregates of the ammonium Salt of dodecatugsrophosphoric Acid.(NH_4)PW_<12>W_<40>:Unidirectionally Oriented Self-Assembly of Nanocrystalites"J.Phys.Chem.B. 101. 9958-9963 (1997)

T.Ito 等人：“十二磷酸铵盐的多孔聚集体的结构。(NH_4)PW_<12>W_<40>：纳米晶的单向定向自组装”J.Phys.Chem.B.

T.Yoshida: "Study on the Dispersion of Nickle lons in NiO-MgO System by X-Ray Absortpion Fine Structure" J.Phys.Chem. 100. (1996)

T.Yoshida：“通过 X 射线吸收精细结构研究镍离子在 NiO-MgO 体系中的分散”J.Phys.Chem。