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Symmetric group approach

An approach to constructing CSFs and matrix elements of the Hamiltonian that initially appears quite different from the symmetric group approach can be developed by considering the second-quantized form of the Hamiltonian. If we have an orthonormal... [Pg.142]

The number of configurations that can be formed from allocating N electrons to n orbitals with spin S is given by a formula due to Weyl and Robinson, but before giving the formula it is useful to establish some similarities and differences to the symmetric group approach. Again, the valid partitions of N (for fermions) must be of the form [2° l6], as we saw above, so we immediately have... [Pg.144]

Symmetric group approach to the theory of Heisenberg lattices... [Pg.603]

The problems involved in the efficient computation of Cl matrix elements can now be appreciated they are largely organizational in character and many brilliant strategies have been devised for their solution. The procedures based on the symmetric-group approach, used here, rest largely on the work of Wormer, Harter and Patterson, Sarma, Rettrup, Duch and Karwowski, and their collaborators the use of alternative algorithms based on the Gel fand tableaux has been de-... [Pg.345]

Fig. 5. a) A methylene group, showing the a and p orbitals (HCH angle 120°). b) The most symmetric approach of methylene to ethylene, c) Level diagram for this approach. Classification of S and A refers to the plane through the midpoint of the double bond, d) Less symmetric a approach. [Pg.9]

In order to proceed further with this approach we shall briefly describe the representation theory of the symmetric group. Consider the partitions of the integer N, that is, sets of non-increasing integers... [Pg.138]

A spin-free approach for valence bond (VB) theory, based on symmetric group techniques, is introduced in this chapter. Bonded tableaux (BT) are adopted to represent VB structures, and a paired-permanent-determinant algorithm is developed to solve the so-called IV problem in the nonorthogonal VB method, followed by the introduction of our ab initio VB program, Xiamen-99. Furthermore, applications of ab initio VB method to the resonance effect, chemical reactions, and excited states are carried out by the Xiamen package. [Pg.143]

Finally, we note that many other important advances have been made in CSF-based approaches, even outside the context of direct CL Much of this effort in recent years has focused on extending the unitary and symmetric group... [Pg.191]

Under the null hypothesis of equal population means, the test statistic follows a t distribution with Kj 4- 2 - 2 degrees of freedom (df), assuming that the sample size in each group is large (that is, > 30) or the underlying distribution is at least mound shaped and somewhat symmetric. As the sample size in each group approaches 200, the shape of the t distribution becomes more like a standard normal distribution. Values of the test statistic that ate fat away from zero would contradict the null hypothesis and lead to its rejection. In particular, for a two-sided test of size a, the critical region (that is, those values of the test statistic that would lead to rejection of the null hypothesis) is defined by t[Pg.148]

Renormalization-Group Approach to the Anderson Model of Dilute Magnetic Alloys. 1. Static Properties for the Symmetric Case. [Pg.221]

The group-theoretical approach is based on the fact that, if equation (5) contains products of internal (symmetry) coordinate displacements Sa(oi = /, y, k,...), then the product SaSfi - Sco and that obtained by any permutation of the indices are indistinguishable. Thus, the n-member products transform according to the permutation (symmetric) group Sn or in another, perhaps more appropriate, notation where... [Pg.18]


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Symmetric group

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