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- W1978248567 abstract "A fully numerical approach to the vibrational Hamiltonian of a polyatomic molecule is presented and applied to four-membered ring molecules. Large amplitude motions (LAMs) and small amplitude vibrations (SAVs) are described by curvilinear coordinates. On the grounds of the adiabatic separation of LAMs and SAVs, a very efficient method of solving the inverse spectral problem is proposed. Coordinate transformations which eliminate the kinetic LAM-SAV interaction and ensure high accuracy of the adiabatic method are discussed." @default.
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- W1978248567 date "1990-09-01" @default.
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- W1978248567 title "A numerical approach to the internal large amplitude motion Hamiltonian of a polyatomic molecule" @default.
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- W1978248567 doi "https://doi.org/10.1016/0022-2852(90)90266-s" @default.
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