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MODE-COUPLING APPROACH TO THE SPIN
DYNAMICS OF EUROPIUM COMPOUNDS
A. Cuccoli, S. Lovesey, V. Tognetti
To cite this version:
JOURNAL DE PHYSIQUE
Colloque C8, Suppl6ment au no 12, Tome 49, dBcembre 1988
MODE-COUPLING APPROACH TO
THESPIN DYNAMICS OF EUROPIUM
COMPOUNDS
A. Cuccoli (I), S. W. Lovesey (') and V. Tognetti (I)
(I) Dipartimento di Fisica UniversitaJ, L. F e m i , 2 50125 Firenze, Italy (') Rutherford Appleton Laboratory, Ozfordshire 0 x 1 1 OQX G.B.
Abstract. - The results of a numerical solution of the mode-coupling equations for EuO and EuS taking into account the microscopical properties of the compounds are presented. Good agreement with the available neutron scattering data is found and predictions for further experiments on EuS are given.
The results of high resolution neutron scattering ex- periments on insulating ferromagnetic Europium com- pounds EuO and EuS appeared in literature in recent years [I-41. The particular attention devoted to such compounds, is due to the fact that already in the ear- lier neutron scattering comprehensive investigation on E n 0 and EuS [I] it was shown that the magnetic be- haviour of these systems is very well described by a simple isotropic Heisenberg exchange interaction. The availability of experimental data at and above the or- dering temperature Tc has encouraged a renewal of
theoretical studies on critical and paramagnetic spin fluctuations in Heisenberg ferromagnets.
The most successful theories appear to be those ones based on Renormalization Group (RG) or on the mode-coupling approximation. RG techniques consti- tute a well established method to study the static and dynamic critical properties of a system; they allow to evaluate critical exponents as well as universal func- tions which characterize the critical behaviour. Very recently an attempt has been made t o extend RG cal- culations to temperatures above Tc [5], but some
problems persist to make possible a quantitative com- parison with experimental data. The mode coupling approximation, in spite of its heuristic character, has revealed very useful in many problems of condensed matter physics [6]. For pure Heisenberg magnets, for example, it gives for the critical dynamical scaling ex-
,-
ponent z the value z = 171, in a agreement with 2
the experiments. Moreover it has been shown very recently [8] that by taking into account the dipolar macroscopic interaction, the mode-coupling theory can be able to interpret the unexpected simple exponen- tial decay obtained in neutron spin-echo experiment on EuO at T = Tc and very small wave vector [4],
which remained until now inexplicable.
However the mode-coupling theory appears also suitable t o investigate the dynamical behaviour of fer- romagnetic systems in all the paramagnetic region and throughout the Brillouin Zone. In this paper we present the results of a numerical solution of the mode- coupling equations for EuO and EuS taking into ac-
count the microscopical features of these compounds. This allows to show some distinctive characters which distinguish EuS from EuO that cannot be accounted by previous approximate solutions, which were limited t o simple cubic nearest neighbours interaction [7] or confined to the continuum limit [6].
Europium compounds can be described by a Heisen- berg exchange hamiltonian:
I for an FCC lattice of magnetic ions with S =
-.
The2 experiments [I] have shown that the interaction is re- stricted to nearest neighbours (J1) and next nearest
neighbours ( J z )
.
For EuO: J1 = 1.22' K , J2 = 0.25' Kand a = 5.12 A; for EuS: J1 = 0.48' K , J2 = -0.24' K and a = 5.95 A, a being the lattice constant.
The final result given by the mode-coupling theory is the following integr~differential equation:
for the relaxation function Fq ( t )
,
whose Fourier Trans- form is related to the measured scattering function S (q, w ) by the relation:W
(q' W, = 1
-
exp (-v/KBT).x
(4) F, ( w ).
(3)Not with standing formal differences in the various derivations, behind equation (2) is the following fun- damental approximation: correlation and relaxation functions among more than two spin operators have been decoupled. Equation (2) is only one of the forms in which this equation is obtained, however all such forms are equivalent if we use for the static suscepti- bility that one given by the spherical model:
C8
-
1572 JOURNAL DE PHYSIQUEThis susceptibility turns out t o be compatible with the dynamical equation (2).
The temperature dependent parameter X appearing in equation (4) can be evaluated by using the sum rule:
(I/N)
C
T X ~ =s
(S+
1) /3. kThe comparison with the experimental data [I], of the calculated X , = 0 and the correlations length KT' which appears in the low q approximation of X,, X , z
A shows good agreement.
":
-
q2The method followed to obtain the solution of equa- tion (2) has been described in detail elsewhere [9].
An extensive comparison of the results of our cal- culation with the available experimental and spin dy- namics simulation data
[lo]
has been made [9], and a good agreement has been generally found both with constant q and constant energy spectra. For constant energy spectra at T = T, the agreement is not verysatisfactory at low energy transfer, where the exper- imental data are very well reproduced by RG, which otherwise fails at high energy. At constant wave vec- tors our line shapes reproduce very well the experimen- tal ones a t various temperatures and wave vectors. A typical result is shown in figure 1.
I
F(w) ( rneVF1 EuO T=1.68Tc q=1.06 A-'Fig. 1. - Comparison of our numerical results with spin dynamics calculation
[lo]
and neutron scattering data [2] at T = 1.68 T, and q = 1.06A-'
for EuO. Full line: our numerical results; dashed line: three poles approximation using the parameter fitted in 121; filled quad: neutron data; open triangle: spin dynamics simulation.The most interesting feature is the strong depen- dence of the line shape on the direction of the wave vec- tors in EuS. Such behaviour, which is a direct conse- quence of the competing exchange interactions present in EuS, is here obtained for the first time in the frame- work of the mode-coupling theory. In figure 2, a com- parison is shown of the line shape a t
T
= T, for q = qm, along the three principal directions for EuO and EuS, qm, being the wave vector corresponding to the zone boundary in the (1, 1, 1) direction. In EuO the line shape is the same along all the directions and onlyFig. 2.
-
Mode-coupling theory results for the line shape at T = T, for EuO (la) and EuS (lb) for three different directions of the wave vector. The value of q corresponds in both cases to the zone boundary along: the (1, 1, 1) di- rection. Full line: q along (1, 1, 1); dashed line: q along (1, 1, 0); dot-dashed line: q along (1, 0, 0).small differences, less than 10 %
,
appear in the inten- sity and the line width; on the contray in EuS we see that a t the zone boundary we have a drastic change in the line shape, with the propagation along (1, 1, 1) which conserves a diffusive character whereas that one along (1, 0, 0) approach a damped spin wave like be- haviour. Some experimental data [I11 seems to confirm these results, but new experiments are called t o test also the quantitative accuracy of our predictions.[I] Passell, L., Dietrich, 0. W. and Als-Nielsen, J.,
Phys. Rev. B 11 (1976) pp. 4897,4908 and 4923. [2] Boni, P. and Shirane, G., Phys. R'ev. B 33 (1986)
3012.
[3] Bohn, H. G., Kollmar, A. and Zinn, W., Phys.
Rev. B 11 (1984) 6504.
[4] Mezei, F., Physica 136B (1986) 417. [5] Iro, H., 2. Phys. B 68 (1987) 485.
Lovesey, S. W., Condensed Matt,er Physic: Dy- namic Correlations, Frontiers in Physics, Ben- jamin Cummings, vol. 61 (1986).
Hubbard, J., J. Phys.
C
4 (1971) 53.Rey, E. and Schwabl, F., Convnunication to MECO (Wroclaw) April 1988.
Cuccoli, A., Lovesey, S. W. and Tognetti, V., Preprint 1988.