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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

项目摘要

项目成果

HIROTA Eizi的其他基金

相关文献

中文摘要
翻译
(1)硅烷-水络合物的转动光谱和分子结构我们观察到的转动光谱与文献报道的含有T_d对称分子的络合物的转动光谱完全不同。观测数据表明,该配合物是一种全新的类型,其Si-O距离短而硬,内部运动主要是围绕Si-O轴的内旋转。有人还建议,观察到的每个旋转线的小分裂是由硅烷的内部运动。(2)本文测量了SiH_4-Ar和SiD_4-Ar的转动光谱。前者的A和E成分出现的顺序与通常预期的相反。几套潜在的功能,假设为硅烷-氩相互作用,以解释所观察到的光谱分裂,但分裂的同位素物种的异常依赖性尚未得到解释。(3)Na_3的B-X跃迁分析本文从群论出发,导出了B态赝转动的哈密顿量,并应用于光谱分析。包含在哈密顿量中的七个参数再现了所观察到的光谱,标准偏差为0.012 cm-2<-1>。(4)成功地分析了甲醇二聚体的16个K=0能级和32个K=1能级的跃迁,确定了四种隧穿分裂。
英文摘要
(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.
期刊论文(15)
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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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共 14 条
    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: