Theory of the Deformed Excited State of Polyene
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概要
- 論文の詳細を見る
We consider a singlet excited state of polyene where the bond lengths takedifferent values from those of the ground state for stabilization, and determinea relation between bond length 7? and bond order P for this "deformed" excitedstate. First, we roughly estimate the bond lengths of the deformed excited state ofhexatriene, in terms of a harmonic oscillator model. Secondly, we make a refinedestimation on undecapentaene by the ASMO-SCF-Cl method for m-electrons.Thirdly, a new type of relation between 7? and P is derived for the deformedexcited state by modifying Coulson's type of relation, and the values of its param-eters are reasonably determined.
- 社団法人日本物理学会の論文
- 1977-07-15
著者
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Suzuki Hideo
Department of Information and Network Science, Chiba Institute of Technology
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NAKACHI Kei
Department of Radiobiology/Molecular Epidemiology, Radiation Effects Research Foundation
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Nakachi Kei
Department Of Physics School Of Science And Engineering Waseda University
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Nakachi Kei
Department Of Epidemiology Radiation Effects Research Institute
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SAKURANAGA Masanori
Department of Physiology,Nippon Medical School
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Sakuranaga Masanori
Department Of Physiology Nippon Medical School
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Suzuki Hideo
Department Of Cardiology Surugadai Nihon University Hospital
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Suzuki Hideo
Department of Bioscience Research, Tsukuba Research Laboratory, Toagosei Co., Ltd.
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