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1996 Fiscal Year Final Research Report Summary

Comprehensive Research on Carbon Clusters

Research Project

Project/Area Number 05233106
Research Category

Grant-in-Aid for Scientific Research on Priority Areas

Allocation TypeSingle-year Grants
Research InstitutionTOYOHASHI UNIVERSITY OF TECHNOLOGY

Principal Investigator

OSAWA Eiji  Toyohashi University of Technology, Faculty of Engineering, Professor, 工学部, 教授 (40001763)

Co-Investigator(Kenkyū-buntansha) SUEMATSU Hirohito  University of Tokyo, School of Science, Professor, 大学院・理学研究科, 教授 (70013513)
EGUCHI Shoji  Nagoya University, Faculty of Engineering ; Professor, 工学部, 教授 (50023099)
SHINOHARA Hisanori  Nagoya University, Faculty of Science, Professor, 理学部, 教授 (50132725)
KOINUMA Hideomi  Tokyo Institute of Technology, Research Laboratory of Applied Ceramics, Professo, 応セラ研, 教授 (70011187)
ACHIBA Youji  Tokyo Metropolitan University, Faculty of Science, Professor, 理学部, 教授 (20002173)
Project Period (FY) 1993 – 1996
KeywordsFullerene / Carbon cluster / High-temperature science / Superconductivity / 材料素材
Research Abstract

An extensive project on the basic research of carbon clusters called fullerenes have been carried out in seven groups, 1 higher fullerenes, 2 applications to material science, 3 metal encapsulated fullerenes, 4 synthesis of derivatives, 5 theory and computations, 6 solid state physics and crystals, and 7 biological influence. In the course of three years from 1993 and 1996, a total of 158 scientists participated in the project which received a total of 930,000,000 yen of financial support. A total of 501 original papers have been published so far, of which 2 were published in Nature and one in Science, A total of 840 papers have been presented by these groups to the semiannual General Fullerene Symposium. Some of the major results are as follows.
Higher fullerenes from C_<78> to C_<116> have been isolated and some of them identified.
Carbon nanocapsules containing microcrystals of pure metals of their carbides have been discovered and systematically studied.
A new carbon composite materia … More l having elastic property has been fabricated from C_<60> and carbon nanotubes.
Automatic production of fullerenes by JxB are jet reactor has been tested.
Endohedral molecular structure of Y@C_<82> has been determined by the maximum entropy technique of X-ray diffraction analysis.
Superconductivity has been discovered in silicon clusters encapsulating barium atoms.
Unique dependence of electric properties in carbon nanotubes on the helical pitches has been theoretically predicted.
A program package for the large-scale simulations at the atomistic level has been written based on the mixed basis ab initio molecular dynamics and executed on various aspects of fullerene chemistry and physics.
Polymerization of C60 to polymers in high dimension has been accomplished for the first time.
The first experimental proof for the superconductivity of alkali-doped fullerenes M_3C_<60> in accordance with the BCS theory has been presented.
A water-soluble derivative of C_<60> has been successfully tested as the sensitizer in the photodynamic therapy of cancer. Less

  • Research Products

    (23 results)

All Other

All Publications (23 results)

  • [Publications] E.Osawa: "Average Bond Dissociation Energies of Fullerenes" Fullerene Sci.Technol.5. 167-175 (1997)

    • Description
      「研究成果報告書概要(和文)」より
  • [Publications] E.Osawa: "Nature of Cyclobutane Bonds in the[2+2]Dimer of C60" J.Phys.Chem.101. 1378-1383 (1997)

    • Description
      「研究成果報告書概要(和文)」より
  • [Publications] M.Yoshida: "On the Limitation of Net Algorithm for Enumerating Isomeric Structures of Giant Fullerenes" Fullerene Sci.Technol.4. 1019-1026 (1996)

    • Description
      「研究成果報告書概要(和文)」より
  • [Publications] K.Honda: "Penultimate Intermediates to C60 and C70" Fullerene Sci.Technol.4. 819-834 (1996)

    • Description
      「研究成果報告書概要(和文)」より
  • [Publications] E.Osawa: "Stone-Wales Rearrangements Involving Heptagonal Defects" Fullerene Sci.Technol.4. 939-961 (1996)

    • Description
      「研究成果報告書概要(和文)」より
  • [Publications] M.Yoshida: "The Phason Line:A New Criterion for the Stability of Fullerenes" Electron.J.Theor.Chem.1. 151-162 (1996)

    • Description
      「研究成果報告書概要(和文)」より
  • [Publications] Osawa, E. ; Hirose, Y. ; Kumura, A ; Shibuya, M: "Gu, Z.-n. ; Li, F.-M."Fullerenes in Chinese Ink. A Correction"" Fullerne Sci.Technol.5. 177-194 (1997)

    • Description
      「研究成果報告書概要(欧文)」より
  • [Publications] Slanina, Z. ; Osawa, E.: "Averege Bond Dissociation Energies of Fullerenes." Fullerene Sci.Technol. 5. 167-175 (1997)

    • Description
      「研究成果報告書概要(欧文)」より
  • [Publications] Osawa, S. ; Sakai, M. ; Osawa, E.: "Nature of Cyclobutane Bonds in the [2+2] Dimer of C_<60>" J.Phys.Chem.101. 1378-1383 (1997)

    • Description
      「研究成果報告書概要(欧文)」より
  • [Publications] Yoshida, M. ; Sugiki, T. ; Osawa, E.: "On the Limitation of Net Algorithm for Enumerating Isomeric Structures of Giant Fullernes" Fullerene Sci.Tachnol.4. 1019-1026 (1996)

    • Description
      「研究成果報告書概要(欧文)」より
  • [Publications] Honda, K. ; Osawa, E.: "Penultimate Intermediates to C_<60> and C_<70>" Fullerene Sci. Technol.4. 819-834 (1996)

    • Description
      「研究成果報告書概要(欧文)」より
  • [Publications] Osawa, E. ; Honda, K.: "Stone-Wales Rearrangements Involving Heptagonal Defects" Fullerene Sci.Technol.4 [5]. 939-961 (1996)

    • Description
      「研究成果報告書概要(欧文)」より
  • [Publications] Honda, K. ; Osawa, E. ; Slanina, Z. ; Matsumoto.T.: "Thermal Transformation of Ring-Oopend [2+2] C_<60> Dimer into a Wide-bridged C_<120> Isomer. A Computational Evaluation of Fulvalene-Naphthalene Rearrangements" Fullerene Sci.Technol.5 [5]. 925-938 (1996)

    • Description
      「研究成果報告書概要(欧文)」より
  • [Publications] Yoshida, M. ; Fujita, M. ; Goto, H. ; Hirose, Y. ; Zhao, X. ; Osawa, E.: "Prediction of Favorable Isomeric Structures for the C_<100> to C_<120> Giant Fullerenes. An Application of the Phason Line Criteria, 193" Electron.J.Theor.Chem.1. 163-171 (1996)

    • Description
      「研究成果報告書概要(欧文)」より
  • [Publications] Yoshida, M. ; Fujita, M. ; Goto, H. ; Osawa, E.: "The Phaseon Line : A New Criterion for the Stability of Fullerenes" Electron.J.Theor.Chem.1. 151-162 (1996)

    • Description
      「研究成果報告書概要(欧文)」より
  • [Publications] Slanina, Z. ; Lee, S.-L. ; Yoshida, M. ; Osawa, E.: "Computations on Nineteen Isolated-Pentagon-Rule Isomers of C_<86>" Chem.Phys.209 [1]. 13-18 (1996)

    • Description
      「研究成果報告書概要(欧文)」より
  • [Publications] Jagannadh, B. ; Kunwar, A.C. ; Thagavelu, R.P. ; Osawa, E.: "New Technique for Conformational Sampling of Cyclic Molecules : Using the AMBER Force Field : Application to 18-Crown-6" J.Phys.Chem.100. 14339-14342 (1996)

    • Description
      「研究成果報告書概要(欧文)」より
  • [Publications] Aihara, J. ; Oe, S. ; Yoshida, M. ; Osawa, E.: "Further Test of the Isolated Pentagon Rule. Thermodynamic and Kinetic Stabilities of C_<84> Fullerene Isomers" J.Comput.Chem.17. 1387-1394 (1996)

    • Description
      「研究成果報告書概要(欧文)」より
  • [Publications] Osawa, S. ; Osawa, E.: "Non-rigid Treatment of Interactions between C_<60> Molecules" Fullerene Sci.Technol.4. 329-346 (1996)

    • Description
      「研究成果報告書概要(欧文)」より
  • [Publications] Ikeda, I. ; Honda, K. ; Osawa, E. ; Shiro, M. ; Aso, M. ; Kanematsu, K.: "Structure and Asymmetric Diels-Alder Reactions of Optically Active Allene-1,3-dicarboxylates" J.Org.Chem.61. 2031-2037 (1996)

    • Description
      「研究成果報告書概要(欧文)」より
  • [Publications] Nagashima, H. ; Saito, M. ; Kato, Y. ; Goto, H. ; Osawa, E. ; Haga, M. ; Itoh, K.: "Electronic Structures and Redox Properties of Silylmethylated C_<60>" Tetrahedron. 52. 5053-5064 (1996)

    • Description
      「研究成果報告書概要(欧文)」より
  • [Publications] Osawa, S. ; Osawa, E. ; Harada, M.: "Internal Rotation in the Singly Bonded Dimers of Substituted C_<60>. A Molecular Lever" J.Org.Chem.61. 257-265 (1996)

    • Description
      「研究成果報告書概要(欧文)」より
  • [Publications] Osawa, S. ; Osawa, E. ; Hirose, Y.: "Doubly Bonded C_<60> Dimers and Congeners : Computational Studies of Structures, Bond Energies and Transformations" Fullerene Sci.Technol.3. 565-585 (1995)

    • Description
      「研究成果報告書概要(欧文)」より

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Published: 1999-03-09  

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