Project/Area Number |
07558008
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Research Category |
Grant-in-Aid for Scientific Research (A)
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Allocation Type | Single-year Grants |
Section | 試験 |
Research Field |
Science education
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Research Institution | The University of Tokyo |
Principal Investigator |
OGAWA Keiichiro The University of Tokyo, Graduate School of Arts and Sciences, Associate Professor, 大学院・総合文化研究科, 助教授 (50114426)
|
Co-Investigator(Kenkyū-buntansha) |
KAWANO Yasuro The University of Tokyo, Graduate School of Arts and Sciences, Researc Associate, 大学院・総合文化研究科, 助手 (10262099)
IMAMURA Yasutada The University of Tokyo, Graduate School of Arts and Sciences, Research Associat, 大学院・総合文化研究科, 助手 (40201339)
KIKUCHI Kazuo The University of Tokyo, Graduate School of Arts and Sciences, Associate Profess, 大学院・総合文化研究科, 助教授 (60012423)
NISHIKIORI Shin-ichi The University of Tokyo, Graduate School of Arts and Sciences, Associate Profess, 大学院・総合文化研究科, 助教授 (70134400)
|
Project Period (FY) |
1995 – 1996
|
Project Status |
Completed (Fiscal Year 1996)
|
Budget Amount *help |
¥3,400,000 (Direct Cost: ¥3,400,000)
Fiscal Year 1996: ¥1,400,000 (Direct Cost: ¥1,400,000)
Fiscal Year 1995: ¥2,000,000 (Direct Cost: ¥2,000,000)
|
Keywords | Computer, / Molecular modeling, / Junior course in university, / Chemical education, / Visualization / 大学前記課程 / コンピュータ化学 |
Research Abstract |
Computer is now an indispensable tool in chemical research. Use of computer enables us the visualization and prediction of three dimensional structure of molecules, the calculation and display of molecular orbitals, and so on. To show young students such a modern aspect of chemistry, a course of "computational chemistry" has been opened in the College of Arts and Sciences, The University of Tokyo. For this course, molecular modeling system has been introduced. The system is as follows : ten personal computers with the use of Windows 3.1 and unix server machines connected through the campus network. As molecular modeling software "CAChe" is used. The course is opened for one semester ever year. Following subjects were studied in the course : molecular structure and energy of simple organic molecules, molecular conformation and conformational interconversion of saturated cyclic molecules, structure of metal complexes, structure of macromolecules, molecular orbitals of two or three atomic molecules, pi-molecular orbitals and Diels-Alder reaction, molecular orbitals and electronic spectra. In the last three lectures, each students studied his own subjects as "free research". Many students reported that chemistry becomes interesting for them. I believe that the primary object of this project has been achieved.
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