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Browsing by Subject "nonrelativistic molecular quantum mechanics"

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Nonrelativistic molecular quantum mechanics without approximations: Electron affinities of LiH and LiD

Bubin, Sergiy; Adamowicz, Ludwik (2004)

We took the complete nonrelativistic Hamiltonians for the LiH and LiH2 systems, as well as their deuterated isotopomers, we separated the kinetic energy of the center of mass motion from the Hamiltonians, and with the use ...