Development of algebraic techniques for the atomic open-shell MBPT(3)

The atomic third-order open-shell many-body perturbation theory is developed. Special attention is paid to the generation and algebraic analysis of terms of the wave operator and the effective Hamiltonian as well. Making use of occupation-number representation and intermediate normalization, the third-order deviations are worked out by employing a computational software program that embodies the generalized Bloch equation. We prove that in the most general case, the terms of effective interaction operator on the proposed complete model space are generated by not more than eight types of the $n$-body ($n\geq2$) parts of the wave operator. To compose the effective Hamiltonian matrix elements handily, the operators are written in irreducible tensor form. We present the reduction scheme in a versatile disposition form, thus it is suited for the coupled-cluster approach

On the idempotents of Hecke algebras

We give a new construction of primitive idempotents of the Hecke algebras associated with the symmetric groups. The idempotents are found as evaluated products of certain rational functions thus providing a new version of the fusion procedure for the Hecke algebras. We show that the normalization factors which occur in the procedure are related to the Ocneanu--Markov trace of the idempotents.Comment: 11 page

Proof of Stanley's conjecture about irreducible character values of the symmetric group

R. Stanley has found a nice combinatorial formula for characters of irreducible representations of the symmetric group of rectangular shape. Then, he has given a conjectural generalisation for any shape. Here, we will prove this formula using shifted Schur functions and Jucys-Murphy elements.Comment: 9 page

General expression for the dielectronic recombination cross section of polarized ions with polarized electrons

A general expression for the differential cross section of dielectronic recombination (DR) of polarized electrons and polarized ions is derived by using usual atomic theory methods and is represented in the form of multiple expansions over spherical tensors. The ways of the application of the general expressions suitable for the specific experimental conditions are outlined by deriving asymmetry parameters of angular distribution of DR radiation in the case of nonpolarized and polarized ions and electrons.Comment: 4 page

On the secondly quantized theory of many-electron atom

Traditional theory of many-electron atoms and ions is based on the coefficients of fractional parentage and matrix elements of tensorial operators, composed of unit tensors. Then the calculation of spin-angular coefficients of radial integrals appearing in the expressions of matrix elements of arbitrary physical operators of atomic quantities has two main disadvantages: (i) The numerical codes for the calculation of spin-angular coefficients are usually very time-consuming; (ii) f-shells are often omitted from programs for matrix element calculation since the tables for their coefficients of fractional parentage are very extensive. The authors suppose that a series of difficulties persisting in the traditional approach to the calculation of spin-angular parts of matrix elements could be avoided by using this secondly quantized methodology, based on angular momentum theory, on the concept of the irreducible tensorial sets, on a generalized graphical method, on quasispin and on the reduced coefficients of fractional parentage

Coupled tensorial form for atomic relativistic two-particle operator given in second quantization representation

General formulas of the two-electron operator representing either atomic or effective interactions are given in a coupled tensorial form in relativistic approximation. The alternatives of using uncoupled, coupled and antisymmetric two-electron wave functions in constructing coupled tensorial form of the operator are studied. The second quantization technique is used. The considered operator acts in the space of states of open-subshell atoms

An efficient approach for spin-angular integrations in atomic structure calculations

A general method is described for finding algebraic expressions for matrix elements of any one- and two-particle operator for an arbitrary number of subshells in an atomic configuration, requiring neither coefficients of fractional parentage nor unit tensors. It is based on the combination of second quantization in the coupled tensorial form, angular momentum theory in three spaces (orbital, spin and quasispin), and a generalized graphical technique. The latter allows us to calculate graphically the irreducible tensorial products of the second quantization operators and their commutators, and to formulate additional rules for operations with diagrams. The additional rules allow us to find graphically the normal form of the complicated tensorial products of the operators. All matrix elements (diagonal and non-diagonal with respect to configurations) differ only by the values of the projections of the quasispin momenta of separate shells and are expressed in terms of completely reduced matrix elements (in all three spaces) of the second quantization operators. As a result, it allows us to use standard quantities uniformly for both diagona and off-diagonal matrix elements

Blocks of cyclotomic Hecke algebras and Khovanov-Lauda algebras

We construct an explicit isomorphism between blocks of cyclotomic Hecke algebras and (sign-modified) Khovanov-Lauda algebras in type A. These isomorphisms connect the categorification conjecture of Khovanov and Lauda to Ariki's categorification theorem. The Khovanov-Lauda algebras are naturally graded, which allows us to exhibit a non-trivial Z-grading on blocks of cyclotomic Hecke algebras, including symmetric groups in positive characteristic.Comment: 32 pages; minor changes to section

Spin-other-orbit operator in the tensorial form of second quantization

The tensorial form of the spin-other-orbit interaction operator in the formalism of second quantization is presented. Such an expression is needed to calculate both diagonal and off-diagonal matrix elements according to an approach, based on a combination of second quantization in the coupled tensorial form, angular momentum theory in three spaces (orbital, spin and quasispin), and a generalized graphical technique. One of the basic features of this approach is the use of tables of standard quantities, without which the process of obtaining matrix elements of spin-other-orbit interaction operator between any electron configurations is much more complicated. Some special cases are shown for which the tensorial structure of the spin-other-orbit interaction operator reduces to an unusually simple form

Feigin-Frenkel center in types B, C and D

For each simple Lie algebra g consider the corresponding affine vertex algebra V_{crit}(g) at the critical level. The center of this vertex algebra is a commutative associative algebra whose structure was described by a remarkable theorem of Feigin and Frenkel about two decades ago. However, only recently simple formulas for the generators of the center were found for the Lie algebras of type A following Talalaev's discovery of explicit higher Gaudin Hamiltonians. We give explicit formulas for generators of the centers of the affine vertex algebras V_{crit}(g) associated with the simple Lie algebras g of types B, C and D. The construction relies on the Schur-Weyl duality involving the Brauer algebra, and the generators are expressed as weighted traces over tensor spaces and, equivalently, as traces over the spaces of singular vectors for the action of the Lie algebra sl_2 in the context of Howe duality. This leads to explicit constructions of commutative subalgebras of the universal enveloping algebras U(g[t]) and U(g), and to higher order Hamiltonians in the Gaudin model associated with each Lie algebra g. We also introduce analogues of the Bethe subalgebras of the Yangians Y(g) and show that their graded images coincide with the respective commutative subalgebras of U(g[t]).Comment: 29 pages, constructions of Pfaffian-type Sugawara operators and commutative subalgebras in universal enveloping algebras are adde