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中国物理学会期刊

C+OH(v=0—3, j=0—3)→CO+H反应的准经典轨线研究

CSTR: 32037.14.aps.60.053401

The quasi-classical trajectory study in the reaction C+OH(v=0—3, j=0—3)→CO+H

CSTR: 32037.14.aps.60.053401
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  • 运用准经典轨线方法,在碰撞能为1.0 eV时,研究了反应物OH分子的振转激发对C+OH反应的立体动力学性质的影响.详细地讨论了该反应在不同反应物振转态下的矢量性质. 计算表明,OH分子的振转激发对C+OH反应的矢量性质非常敏感,这种现象在对该反应的标量性质的研究中是不存在的.

     

    The effect of reagent vibrational and rotational excitation on the stereodynamics in the chemical reaction C+OH at the collision energy of 1.0 eV has been carried out by using the quasi-classical trajectory method. The vector property of different vibrational and rotational states has been discussed in detail. The results suggest that the vibrational and rotational excitation of OH are very sensitive to the vector property of the C+OH reaction, which is different from the study of the scalar property of the C+OH reaction.

     

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