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Dewar benzene interaction diagram

Density functional theory, 21, 31, 245-246 B3LYP functional, 246 Hartree-Fock-Slater exchange, 246 Kohn-Sham equations, 245 local density approximation, 246 nonlocal corrections, 246 Density matrix, 232 Determinantal wave function, 23 Dewar benzene, 290 from acetylene + cyclobutadiene, 290 interaction diagram, 297 rearrangement to benzene, 290, 296-297 DFT, see Density functional theory... [Pg.365]


See other pages where Dewar benzene interaction diagram is mentioned: [Pg.280]   
See also in sourсe #XX -- [ Pg.297 ]

See also in sourсe #XX -- [ Pg.297 ]

See also in sourсe #XX -- [ Pg.297 ]

See also in sourсe #XX -- [ Pg.297 ]




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