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B3LYP geometry, transition metal structure

As a simple illustration of transition metal hybridization and Lewis-like structures, let us consider tungsten hexahydride (WHg) as a prototype of idealized sd hybridized bonding. The input file and chosen atomic numbering for the optimized (B3LYP/LANL2DZ-level) geometry of WHs are given in FO-4.16. [Pg.87]

See other pages where B3LYP geometry, transition metal structure is mentioned: [Pg.4]    [Pg.145]    [Pg.122]    [Pg.91]    [Pg.250]    [Pg.129]    [Pg.147]    [Pg.439]    [Pg.55]    [Pg.53]    [Pg.329]    [Pg.21]    [Pg.383]    [Pg.113]    [Pg.358]    [Pg.70]    [Pg.625]    [Pg.151]    [Pg.201]    [Pg.329]    [Pg.452]    [Pg.2256]    [Pg.18]    [Pg.184]    [Pg.48]    [Pg.186]    [Pg.301]   
See also in sourсe #XX -- [ Pg.366 , Pg.367 , Pg.368 , Pg.369 , Pg.370 ]



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