Swh. Eijt et al., SOFT MODES AND PHONON INTERACTIONS IN SN2P2SE6 STUDIED BY MEANS OF NEUTRON-SCATTERING, Journal of physics. Condensed matter, 10(22), 1998, pp. 4811-4844
This paper presents an inelastic neutron scattering study of the prope
r ferroelectric Sn2P2Se6 and elastic neutron scattering results on the
satellite diffraction pattern which characterizes the modulated phase
. The temperature dependences of the satellite intensities and modulat
ion wavevector are in fair agreement with results from previous x-ray
experiments. Close to the incommensurate-to-ferroelectric transition t
emperature T-c, an unexpected intensity overshoot is observed, similar
to that seen in birefringence and dilatation experiments. The relatio
nship between the lattice dynamics and the observed phase transition s
equence is examined. The dispersion of the ferroelectric soft optic ph
onon (P-x-polarization) and of the acoustic phonons is followed along
the a- and c*-directions. In the ferroelectric phase, the TO mode sho
ws a considerable softening as the incommensurate phase is approached
from below. In the paraelectric (T > T-i) and incommensurate (T-c < T
< T-i) phases, the response from the TO (P-x-polarization) and TA (par
tial derivative u(x)/partial derivative z strain) branches has been in
vestigated via a series of constant-q scans in the c-direction (appro
ximately the modulation wavevector direction). The combined inelastic
line-shapes, as observed in a number of non-equivalent Brillouin zones
, could all be analysed in terms of a coupled-mode damped harmonic osc
illator model. In addition, a diverging, resolution-limited, central p
eak is observed close to T-i. It is suggested that the TO-TA coupling
lies at the origin of the incommensurate instability. A phenomenologic
al free energy is developed, in the continuum approximation, in which
the TO-TA interaction is included via a pseudo-Lifshitz term of the ty
pe (partial derivative u(x)/partial derivative z)(partial derivative P
-x/partial derivative z).