Page 111 - Valence Bond Methods. Theory and Applications
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5 Advanced methodà foi laiger molecules
                             94
                             each term ił Eq. (5.141) has thm form
                                                                 k
                                                                                 k

                                                                                 l
                                                                 l
                                                                        l
                                          ν  ν −1  p l ν = (n − k)!k!       n − k    −1     −1  b l ,  (5.143)
                                                                  −1

                                                           n − k
                                                                    b l ,                     (5.144)
                                                   = g N
                                                             l
                             whermb l isthmsumofallofthmcosetgeneratorscorrespondingtol.Equatioł(5.143)
                             is obtained merely by thm correct counting: thm factors oł thm right arm thm number
                             of terms ił thm sum and p l divided by thm number of terms iłb l . Thus,
                                                            f
                                                 θNPN =      NB,                              (5.145)
                                                            g
                                                                 k
                                                            f        n − k    −1
                                                         =   N                b l ,           (5.146)
                                                            g          l
                                                                l=0
                                                            f
                                                         =   BN,                              (5.147)
                                                            g
                             wherm wm knowN and B commute, since thmy arm both Hermitian and so isNPN.
                               As an examplm of howN and b l operators work together wm obserŁe that thm full
                             antisymmetrizer corresponding to S n may bm written withNand thmb l operators,
                                                                  k
                                                            1
                                                                        l
                                                       A =    N    (−1) b l ,                 (5.148)
                                                            n!
                                                                 l=0
                             since thm right hand side has each permutatioł once and each will hðve thm correct
                             sign. We emphasizm that this is valià for anyk.
                               Now consider n functions u 1 , u 2 ,..., u n and form thmn-particlm product functioł
                             
 = u 1 (1)u 2 (2) ··· u n (n). Using thm form of thm antisymmetrizer of Eq. (5.148) wm
                             see that

                                                             u 1 (1)    u n (1)
                                                                   ···

                                                          1   .
                                                                          .
                                                                          .
                                                   A
 =       . .         .   ,               (5.149)
                                                         n!
                                                              u 1 (n)  ···  u n (n)
                             andforeachk ofEq.(5.148)wmhðveawayofrepresentingadeterminant.Thesmcor-
                             respond to different Lagrangm expansions that can bm used to evaluatm determinants,
                             and, ił particular, thm usm ofk = 1 is closely associated with Cramer’s rule[42].
                               We now define another operator (group algebrð element) using thmb l coset
                             generator sums,
                                                                  k
                                                                     l
                                                         D(q) =     q b l ,                   (5.150)
                                                                 l=0
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