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Molecular systems complex representation

Nonlinear coupling, multidegenerate conditions higher order coupling, complex representations, 243-244 molecular systems, 233-249 adiabatic-to-diabatic transformation, 241— 242... [Pg.89]

D. F. Coker and S. Bonella (2006) Linearized non-adiabatic dynamics in the adiabatic representation. In David Micha and Irene Burghardt, editors, Quantum dynamics of complex molecular systems. Springer-Verlag, Berlin, p. 307... [Pg.588]

W.H. Miller, The initial value representation of semiclassical theory A practical way of adding quantum effects to classical molecular dynamics simulations of complex molecular systems, in K.K. Phua, A. Zewail, (Eds.), Physical Biology-From Atoms to Cells, 51 Conference on Chemical Research, London, UK, 2008. Imperial College Press, London, UK, 2008, pp. 505-525. [Pg.329]

The ideas presented above on the representation of bonding in molecular structures by electron. systems can be extended to the different t> pcs of bonding in or-ganoinetallic complexes. Such a system has not yet been fully elaborated but tire scheme is illustrated with one example, the case of multi-haptic bonds. [Pg.69]


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