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Eyring parameters rotation

We shall present results for several kinds of potential energy surfaces. Many of the surfaces are obtained by the London-Eyring-Polanyi-Sato (LEPS) method, involving a single adjustable (Sato) parameter, or by the extended LEPS method, in which different Sato parameters are used for different atomic pairs. These methods are reviewed elsewhere.For other calculations we used rotated Morse curves (RMC),semiempirical valence bond (VB) surfaces, and rotated-Morse-bond-energy-bond-order (RMBEBO) surfaces. [Pg.597]

See other pages where Eyring parameters rotation is mentioned: [Pg.40]    [Pg.470]    [Pg.91]    [Pg.326]    [Pg.91]    [Pg.506]    [Pg.39]    [Pg.44]    [Pg.103]    [Pg.141]    [Pg.243]    [Pg.262]   
See also in sourсe #XX -- [ Pg.31 ]



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