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Many-body perturbation theory open-shell molecules

The interaction energies of clusters of molecules can be decomposed into pair contributions and pairwise-nonadditive contributions. The emphasis of this chapter is on the latter components. Both the historical and current investigations are reviewed. The physical mechanisms responsible for the existence of the many-body forces are described using symmetry-adapted perturbation theory of intermolecular interactions. The role of nonadditive effects in several specific trimers, including some open-shell trimers, is discussed. These effects are also discussed for the condensed phases of argon and water. [Pg.919]


See other pages where Many-body perturbation theory open-shell molecules is mentioned: [Pg.53]    [Pg.270]    [Pg.292]    [Pg.274]    [Pg.186]    [Pg.509]    [Pg.400]    [Pg.178]    [Pg.178]    [Pg.635]    [Pg.441]   


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Many-body perturbation theory open-shell

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