On the Dynamical Spin Susceptibility of Paramagnetic La2CuO4

1990 ◽  
Vol 193 ◽  
Author(s):  
H. Winter ◽  
Z. Szotek ◽  
W. M. Temmerman

ABSTRACTThe self-consistent one-electron wave functions and energy bands obtained by the LMTO-ASA method within the local density approximation (LDA) are used to calculate the wave vector and frequency dependent non-interacting spin susceptibility of paramagnetic La2CuO4 in the body-centred tetragonal (bct) structure. We show that the tendency towards the antiferromagnetic instability is strongly dependent on the effects of the matrix elements which lead to a substantial depression of the susceptibility, especially near the X-point. The Fermi surface nesting properties, although important for the susceptibility, are by far not sufficient for the instability and the interband transitions turn out to be of great significance. Our results indicate that the susceptibility is at least 3 times too small to drive this system through a transition to the antiferromagnetic state, and we discuss possible reasons for this failure.

2008 ◽  
Vol 2008 ◽  
pp. 1-4 ◽  
Author(s):  
Andrei V. Zenkov

Specific features of the charge-transfer (CT) states and O2p→Cr3d transitions in the octahedral (CrO6)9− complex are considered in the cluster approach. The reduced matrix elements of the electric-dipole transition operator are calculated on many-electron wave functions of the complex corresponding to the initial and final states of a CT transition. Modeling the optic spectrum of chromites has yielded a complicated CT band. The model spectrum is in satisfactory agreement with experimental data which demonstrates the limited validity of the generally accepted concept of a simple structure of CT spectra.


2019 ◽  
Vol 222 ◽  
pp. 03011
Author(s):  
A.V. Eskin ◽  
V.I. Korobov ◽  
A.P. Martynenko ◽  
V.V. Sorokin

The hyperfine structure of energy levels of muonic molecules tdµ, tpµ and dpµ is calculated on the basis of stochastic variational method. The basis wave functions are taken in the Gaussian form. The matrix elements of the Hamiltonian are calculated analytically. Vacuum polarization, relativistic and nuclear structure corrections are taken into account to increase the accuracy. For numerical calculation, a computer code is written in the MATLAB system. Numerical values of energy levels of hyperfine structure in muonic molecules tdµ, tpµ and dpµ are obtained.


This paper is an extension of the preceding one to the case of transitions from a state of discrete energy to one in the continuous region. By summing the transition probabilities from the ground state to the states in the continuous region an expression is obtained for the probability of evaporation from a solid surface. We are thus able to evaluate the average length of time spent by an adsorbed atom on a surface. 2- Transition Probabilities In order to calculate the matrix elements corresponding to transitions to states of positive energy, we must first consider the wave functions of the continuous spectrum of the equation (3a) of the preceding paper.


2002 ◽  
Vol 11 (04) ◽  
pp. 265-271 ◽  
Author(s):  
SHISHAN DONG ◽  
SHI-HAI DONG

The eigenvalues and eigenfunctions of the Schrödinger equation with a non-relativistic electron in a uniform magnetic field are presented. A realization of the creation and annihilation operators for the radial wave-functions is carried out. It is shown that these operators satisfy the commutation relations of an SU(1,1) group. Closed analytical expressions are evaluated for the matrix elements of different functions ρ2 and [Formula: see text].


1974 ◽  
Vol 29 (6) ◽  
pp. 859-866 ◽  
Author(s):  
A. Grauel

Introducing correlated continuum wave functions for the two- and re-particle-continuum a microscopic theory of nuclear reactions based on a method of Fano is developed. The S-matrix-elements are given by the matrix-elements between correlated continuum wave functions and bound state wave functions. The antisymmetrization of the continuum wave functions with more than one particle in the continuum is included. The theory can be straightforwardly applied on the n-nucleon-emission process following photo- and particle excitations.


2003 ◽  
Vol 12 (06) ◽  
pp. 809-815 ◽  
Author(s):  
SHI-HAI DONG ◽  
GUO-HUA SUN ◽  
YU TANG

The eigenvalues and eigenfunctions of the Schrödinger equation with a Pöschl–Teller (PT)-like potential are presented. A realization of the creation and annihilation operators for the wave functions is carried out. It is shown that these operators satisfy the commutation relations of an SU(1,1) group. Closed analytical expressions are evaluated for the matrix elements of different functions, sin (ρ) and [Formula: see text] with ρ=πx/L.


2021 ◽  
Vol 2021 (12) ◽  
Author(s):  
Sergey Derkachov ◽  
Gwenaël Ferrando ◽  
Enrico Olivucci

Abstract We present a basis of eigenvectors for the graph building operators acting along the mirror channel of planar fishnet Feynman integrals in d-dimensions. The eigenvectors of a fishnet lattice of length N depend on a set of N quantum numbers (uk, lk ), each associated with the rapidity and bound-state index of a lattice excitation. Each excitation is a particle in (1 + 1)-dimensions with O(d) internal symmetry, and the wave-functions are formally constructed with a set of creation/annihilation operators that satisfy the corresponding Zamolodchikovs-Faddeev algebra. These properties are proved via the representation, new to our knowledge, of the matrix elements of the fused R-matrix with O(d) symmetry as integral operators on the functions of two spacetime points. The spectral decomposition of a fishnet integral we achieved can be applied to the computation of Basso-Dixon integrals in higher dimensions.


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