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Diabatic analysis of the electronic states of hydrogen chloride
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12.More generally, the diabatic potential energy function is obtained by solving the secular equation where the solutions are either the adiabatic or the Born–Oppenheimer potential energy curves defined in the text. In the latter case, has the absolute value
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17.See p. 98 of Ref. 10. The γL⋅S part of couples the same states as the rotation-electronic operator and the part of the spin-orbit operator, but this effect is very small and is commonly absorbed into the and b perturbation parameters.
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20.See AIP Document No. PAPS JCPSA6-109-009839 for 22 pages of tables of diabatic state characters of the electronic states of HCl and DCl. Order by PAPS number and journal reference from American Institute of Physics, Physics Auxiliary Publications Service, 500 Sunnyside Boulevard, Woodbury, New York 11797-2999. Fax: 516-576-2223, e-mail: firstname.lastname@example.org. The price is $1.50 for each microfiche (98 pages) or $5.00 for photocopies of up to 30 pages, and $0.15 for each additional page over 30 copies. Airmail additional. Make checks payable to the American Institute of Physics.
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28.The interaction between the and the states is forbidden both because ΔΛ=2 and also because their configurations differ by two orbitals. The latter is also true for the interaction; however, in that case Rydberg–valence mixing in the b state relaxes this restriction.
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