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Electron and nuclear density matrices and the separation of electronic and nuclear motion
Authors:O. Goscinski  A. Palma
Abstract:The so-called parametric dependency of the electronic wave function in the Born–Oppenheimer approximation is discussed. Considering a function beyond this approximation, a new set of equations is derived with parametric and nonparametric dependency. Nuclear and electron reduced density matrices are introduced in this derivation. They are used in a formulation of the problem of separation of nuclear and electronic motion.
Keywords:
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