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Study of vib-rotational spectra of van der Waals complexes containing SH4 and CH4

Research Project

Project/Area Number 09640614
Research Category

Grant-in-Aid for Scientific Research (C)

Allocation TypeSingle-year Grants
Section一般
Research Field Physical chemistry
Research InstitutionKanagawa Institute of Technology

Principal Investigator

KAWASHIMA Yoshiyuki  Kanagawa Inst. of Tech, Engineering, Professor, 工学部, 教授 (60131009)

Project Period (FY) 1997 – 1998
Project Status Completed (Fiscal Year 1998)
Budget Amount *help
¥500,000 (Direct Cost: ¥500,000)
Fiscal Year 1998: ¥500,000 (Direct Cost: ¥500,000)
Keywordsvan der Waals molecule / microwave spectroscopy / rotational spectrum / Internal rotation / silane / フーリエ交換マイクロ波分光 / シラン錯体
Research Abstract

We have searched for rotational spectra of CD4--H20 and GeH4--H20 using a Fourier transform microwave (FTMW) machine which was built in our lab in 1998. Very recently we succeeded in observing the rotational spectra of CD4--H20, However, we could not detect a spectrum of GeH4--H20 and are still searching it. When a rotational spectrum of CH4--NO was searched, many absorption lines of trans- and cis-HONO and N2O3 were observed. Next we considered how to explain the difference between the spectral patterns of Ar--SiH4 and Ar--SiD4 which had already been observed using a FTMW spectrometer. It was difficult to explain the observed spectral patterns considering only a Coriolis interaction term, which couples the internal rotation of SiH4 and the end-over-end rotation of the complex. Then we considered an anisotropic potential of a van der Waals stretching mode for Ar--SiH4 and expanded this potential by a power series of van der Waals bond distance. In order to fit the observed spectral patterns of Ar--SiH4 and Ar-. SiD4, the potential orders were chosen to be -15 and -9, respectively. These values were corresponded to the repulsive and attractive forces of the Lennard-Jones potential for a spherical top molecule. In the addition, we tried to explain the observed rotational spectra of SiH4--H20 system by taking account for a diagonalization of the general internal rotation Hainiltonian. The potential barrier of SiH4--H20 was estimated to be about 260 cm- 1 because of rather strong hydrogen bonding. Finally, analyzing the rotational spectra of the excited vibrational states for LiBH4 and NaBH4, the energy differences and the Coriolis interaction constants were determined.

Report

(3 results)
  • 1998 Annual Research Report   Final Research Report Summary
  • 1997 Annual Research Report
  • Research Products

    (3 results)

All Other

All Publications (3 results)

  • [Publications] E.Hirota: "Internal Motion in Lithium Tetrahydroborate LiBH_4" J.Molecular Spectroscopy. 181. 352-356 (1997)

    • Description
      「研究成果報告書概要(和文)」より
    • Related Report
      1998 Final Research Report Summary
  • [Publications] E.Hirota and Y.Kawashima: "Internal Motion in Lithium Tetrahydroborate LiBH4" J.Mol.Spectrosc.Vol.181. 352-356 (1997)

    • Description
      「研究成果報告書概要(欧文)」より
    • Related Report
      1998 Final Research Report Summary
  • [Publications] E.Hirota: "Internal Motion in Lithium Tetrahydroborate LiBH_4" J.Moleculor Spectroscopy. 181. 352-356 (1997)

    • Related Report
      1998 Annual Research Report

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Published: 1998-04-01   Modified: 2016-04-21  

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