期刊
CHEMICAL PHYSICS LETTERS
卷 372, 期 1-2, 页码 1-7出版社
ELSEVIER
DOI: 10.1016/S0009-2614(03)00362-2
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In this Letter we study the influence of proper treatment of the conical intersection on photo-absorption cross-section of the C2H molecule. The treatment is based on the diabatization of the adiabatic potentials employing the adiabatic-to-diabatic transformation. To facilitate the calculations we adopt a simple two-dimensional model. (C) 2003 Elsevier Science B.V. All rights reserved.
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