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Studies on Molecular Systams Formed by Novel Interactions

Studies on Molecular Systams Formed by Novel Interactions
新型相互作用形成的分子系统研究
批准号:
08044064
负责人:
HIROTA Eizi
金额:
$6.14万
依托单位国家:
日本
项目类别:
Grant-in-Aid for international Scientific Research
财政年份:
1996
资助国家:
日本
项目状态:
已结题
起止时间:
1996 至 1997

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(1) Rotational Spectrum and Molecular Structure of the Silane-Water ComplexWe observed the rotational spectra which completely differ from those reported for complexes containing a T_d symmetry molecule. The observed data led to the conclusions that the complex is of completely new type with a short and hard Si-O distance and that the main internal motion is the internal rotation around the Si-O axis. It was also suggested that small splittings observed for each rotational line are caused by the internal motion of silane.(2) Rotational spectrum of the Silane-Argon ComplexThe spectrum was measured for both SiH_4-Ar and SiD_4-Ar. The A and E components of the former appeared in the order opposite to that normally expected. Several sets of potential functions were assumed for the silane-argon interaction in order to explain the observed splittings of the spectra, but the anomalous dependence of the splittings on isotopic species has not been explained.(3) Analysis of the B-X Transition of Na_3A Hamiltonian for the pseudo-rotation in the B state was derived based upon a group-theoretical consideration and was applied to the analysis of the observed spectra. Seven parameters included in the Hamiltonian reproduced the observed spectra with the standard deviation of 0.012 cm^<-1>.(4) Analysis of the Methanol DimerTransition involving 16 K=0 levels and 32 K=1 levels were successfully analyzed, resulting in determination of four kinds of tunneling splittings.
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会议论文
S.Bierman, J.Hoeft, T.Torring, F.J. Lovas, R.D.Suenram, Y.Kawashima, and E.Hirota: "Microwave spectroscopy of mixed alkali halide dimers:LiNaF_2" Journal of Chemical Physics. 105. 9754-9761 (1996)
S.Bierman、J.Hoeft、T.Torring、F.J. Lovas、R.D.Suenram、Y.Kawashima 和 E.Hirota:“混合碱金属卤化物二聚体的微波光谱:LiNaF_2”化学物理杂志。
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N.Ohashi, M.Tsuura, J.T.Hougen, W.E.Ernst, and S.Rakowsky: "Effective Rotation-Psudorotation Hamiltonian for X_3-Type Molecules:Application to the B-X Transition of Na_3" Journal of Molecular Spectroscopy. 184. 22-34 (1997)
N.Ohashi、M.Tsuura、J.T.Hougen、W.E.Ernst 和 S.Rakowsky:“X_3 型分子的有效旋转-赝旋转哈密顿量:在 Na_3 的 B-X 转变中的应用”分子光谱学杂志。
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E.Hirota and Y.Kawashima: "Internal Motion in Lithium Tetrahydroborate LiBH_4" Journal of Molecular Spectroscopy. 181. 352-356 (1997)
E.Hirota 和 Y.Kawashima:“四氢硼酸锂 LiBH_4 的内部运动”分子光谱学杂志。
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14
    Dynamical molecular structure of the NO3 radical : a fundamental NOx molecule
    Survey Research on the Future Conception of Chemistry
    Coordination of the Studies on Free Radical Science
    • 批准号:
      05237103
    • 项目类别:
      Grant-in-Aid for Scientific Research on Priority Areas
    • 资助金额:
      $12.93万
    • 财政年份:
      1993
    • 负责人:
      HIROTA Eizi
    • 依托单位:
    Studies on Strongly Coupled Molecular Systems
    • 批准号:
      05044045
    • 项目类别:
      Grant-in-Aid for international Scientific Research
    • 资助金额:
      $6.4万
    • 财政年份:
      1993
    • 负责人:
      HIROTA Eizi
    • 依托单位: