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Application of Multichannel Quantum Defect Theory to the Triatomic van der Waals Predissociation Process
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  • Application of Multichannel Quantum Defect Theory to the Triatomic van der Waals Predissociation Process
  • Application of Multichannel Quantum Defect Theory to the Triatomic van der Waals Predissociation Process
저자명
Lee. Chun-Woo
간행물명
Bulletin of the Korean Chemical Society
권/호정보
1991년|12권 2호|pp.228-238 (11 pages)
발행정보
대한화학회
파일정보
정기간행물|ENG|
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이 논문은 한국과학기술정보연구원과 논문 연계를 통해 무료로 제공되는 원문입니다.
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기타언어초록

Generalized multichannel quantum defect theory [C. H. Greene et al. Phys. Rev., A26, 2441 (1982)] is implemented to the vibrational predissociation of triatomic van der Waals molecules. As this is the first one of such an application, the dependences of the quantum defect parameters on energy and radius are examined carefully. Calculation shows that, in the physically important region, quantum defect parameters remain smoothly varying functions of energy for this system as in atomic applications, thus allowing us very coarse energy mesh calculations for the photodissociation spectra. The choice of adiabatic or diabatic potentials as reference potentials for the calculation of quantum defect parameters as done by Mies and Julienne [J. Chem. Phys., 80, 2526 (1984)] can not be used for this system. Physically motivated reference potentials that may be generally applicable to all kinds of systems are utilized instead. In principle, implementation can be done to any other predissociation processes with the same method.