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REDUCED DENSITY MATRIX VERSUS WAVE FUNCTION                             71
                             terms is a product of (N – i) 1-RDM elements with an i-RDM element, (i.e.
                             the 1-RDM plays a similar role to the Krönecker deltas).  Thus,  for instance:












                             is spin-forbidden and must  be eliminated.
                        The inference process leading to equations (45) and (49) was carried out with the help
                        of a set of graphs specially suited for operating with RO’s. This graphical method has
                        been described in several recent publications [26,27,47] and would excessively lengthen
                        this  paper; therefore, I would like to mention its usefulness  without  elaborating.
                        The interest of  relation  (49)  lies in  that the holes and  the particle parts of  the
                        equation, have the same structure.
                        Equations  (45) and  (49)  stress the  direct connexion  existing  between the elements
                        and classes of the Symmetric Group of Permutations and  the terms derived by com-
                        muting/anticommuting  groups of  fermion  operators  after  summing  with  respect to
                        the spin variables.
                        Two important  facts  concerning the set of  relations  given  above are  that  all the
                        N-representability relations known  to us, can  be derived from  (45) (or  (44) in a spin-
                        space representation)  by  varying the value of N  and relation (49)  condenses  them
                        all.
                        It is interesting to note that relation (45) guaranties that the N-electron state of refer-
                        ence  (whose superindex has  been omitted) is  antisymmetric since the RO's involved
                        on the  l.h.s of these equations  operate on N-electron states.  Now, by  contracting
                        this equation to a p-electron space an N-representable equation is obtained  (by con-
                        struction). In  view of  this, I  hoped  that a  relation  obtained in  such a  way  would
                        be a sufficient N-representability condition or at  least  more stringent than  the  (45)
                        equation for N  =  p. Now  the  contraction  of equation  (45)  gives  exactly the  same
                        equation where N  has  been replaced by p. On  the other  hand the  contraction of
                        equation  (49) gives  a very complicated equation where  partial  traces of RDM’s of
                        orders (p + l),(p + 2),....(N  –  1)  appear.  This equation although difficult to analyse
                        may prove to be useful and it  is being  studied at  the  moment.


                        5.4.2. Approximation  proposed
                        The method  for approximating  an RDM in  terms  of  the  lower order  ones is based
                        on equation  (49).  The working hypothesis which has been put  forward  [46] is:
                        ”Let us  assume  that Holes and Particles are  totally  different  objects. If  this as-
                        sumption  were true,  equation (49)  could be  exactly decoupled  into two  equations,
                        one involving RDM’s of different  orders and  the other, of similar  structure, linking
                        HRDM’s of different  orders”.
                        This hypothesis, given that Holes and Particles are related through the N-repre-
                        sentability conditions, is not true. On the other hand, by taking into account several
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