455 research outputs found
Polarization states of polydomain epitaxial Pb(Zr1-xTix)O3 thin films and their dielectric properties
Ferroelectric and dielectric properties of polydomain (twinned)
single-crystal Pb(Zr1-xTix)O3 thin films are described with the aid of a
nonlinear thermodynamic theory, which has been developed recently for epitaxial
ferroelectric films with dense laminar domain structures. For Pb(Zr1-xTix)O3
(PZT) films with compositions x = 0.9, 0.8, 0.7, 0.6, 0.5, and 0.4, the "misfit
strain-temperature" phase diagrams are calculated and compared with each other.
It is found that the equilibrium diagrams of PZT films with x > 0.7 are similar
to the diagram of PbTiO3 films. They consist of only four different stability
ranges, which correspond to the paraelectric phase, single-domain tetragonal
ferroelectric phase, and two pseudo-tetragonal domain patterns. In contrast, at
x = 0.4, 0.5, and 0.6, the equilibrium diagram displays a rich variety of
stable polarization states, involving at least one monoclinic polydomain state.
Using the developed phase diagrams, the mean out-of-plane polarization of a
poled PZT film is calculated as a function of the misfit strain and
composition. Theoretical results are compared with the measured remanent
polarizations of PZT films grown on SrTiO3. Dependence of the out-of-plane
dielectric response of PZT films on the misfit strain in the heterostructure is
also reported.Comment: 23 pages, 4 figure
Decoupling of a Neutron Interferometer from Temperature Gradients
Neutron interferometry enables precision measurements that are typically
operated within elaborate, multi-layered facilities which provide substantial
shielding from environmental noise. These facilities are necessary to maintain
the coherence requirements in a perfect crystal neutron interferometer which is
extremely sensitive to local environmental conditions such as temperature
gradients across the interferometer, external vibrations, and acoustic waves.
The ease of operation and breadth of applications of perfect crystal neutron
interferometry would greatly benefit from a mode of operation which relaxes
these stringent isolation requirements. Here, the INDEX Collaboration and
National Institute of Standards and Technology demonstrates the functionality
of a neutron interferometer in vacuum and characterize the use of a compact
vacuum chamber enclosure as a means to isolate the interferometer from spatial
temperature gradients and time-dependent temperature fluctuations. The vacuum
chamber is found to have no depreciable effect on the performance of the
interferometer (contrast) while improving system stability, thereby showing
that it is feasible to replace large temperature isolation and control systems
with a compact vacuum enclosure for perfect crystal neutron interferometry
Superparaelectric phase in the ensemble of non-interacting ferroelectric nanoparticles
For the first time we predict the conditions of superparaelectric phase
appearance in the ensemble of non-interacting spherical ferroelectric
nanoparticles. The superparaelectricity in nanoparticle was defined by analogy
with superparamagnetism, obtained earlier in small nanoparticles made of
paramagnetic material. Calculations of correlation radius, energetic barriers
of polarization reorientation and polarization response to external electric
field, were performed within Landau-Ginzburg phenomenological approach for
perovskites Pb(Zr,Ti)O3, BiFeO3 and uniaxial ferroelectrics rochelle salt and
triglycine sulfate.Comment: 28 pages, 7 figures, 3 Appendices, to be submitted to Phys. Rev.
Phenomenological theory of phase transitions in highly piezoelectric perovskites
Recently discovered fine structure of the morphotropic phase boundaries in
highly piezoelectric mixture compounds PZT, PMN-PT, and PZN-PT demonstrates the
importance of highly non-linear interactions in these systems. We show that an
adequate Landau-type description of the ferroelectric phase transitions in
these compounds is achieved by the use of a twelfth-order expansion of the
Landau potential in terms of the phenomenological order parameter.
Group-theoretical and catastrophe-theory methods are used in constructing the
appropriate Landau potential. A complete phase diagram is calculated in
phenomenological parameter space. The theory describes both PZT and PZN-PT
types of phase diagrams, including the newly found monoclinic and orthorhombic
phases. Anomalously large piezoelectric coefficients are predicted in the
vicinity of the phase transition lines.Comment: RevTex4, 8 pages, 2 figures. Dramatically changed after referees'
Comments, to appear in Phys. Rev. B, 1 April 200
Origin of the high piezoelectric response in PbZr(1-x)TixO3
High resolution x-ray powder diffraction measurements on poled PbZr(1-x)TixO3
(PZT) ceramic samples close to the rhombohedral-tetragonal phase boundary (the
so-called morphotropic phase boundary, MPB) have shown that for both
rhombohedral and tetragonal compositions, the piezoelectric elongation of the
unit cell does not occur along the polar directions but along those directions
associated with the monoclinic distortion. This work provides the first direct
evidence for the origin of the very high piezoelectricity in PZT.Comment: 4 pages, 4 EPS figures embedded. More specific title and abstract. To
appear in Phys. Rev. Let
Utilizing Weightlifting for Cycling Performance
Abstract available in the 9th Annual Coaches and Sport Science College
Thermodynamics of nanodomain formation and breakdown in Scanning Probe Microscopy: Landau-Ginzburg-Devonshire approach
Thermodynamics of tip-induced nanodomain formation in scanning probe
microscopy of ferroelectric films and crystals is studied using the
Landau-Ginzburg-Devonshire phenomenological approach. The local redistribution
of polarization induced by the biased probe apex is analyzed including the
effects of polarization gradients, field dependence of dielectric properties,
intrinsic domain wall width, and film thickness. The polarization distribution
inside subcritical nucleus of the domain preceding the nucleation event is very
smooth and localized below the probe, and the electrostatic field distribution
is dominated by the tip. In contrast, polarization distribution inside the
stable domain is rectangular-like, and the associated electrostatic fields
clearly illustrate the presence of tip-induced and depolarization field
components. The calculated coercive biases of domain formation are in a good
agreement with available experimental results for typical ferroelectric
materials. The microscopic origin of the observed domain tip elongation in the
region where the probe electric field is much smaller than the intrinsic
coercive field is the positive depolarization field in front of the moving
counter domain wall. For infinitely thin domain walls local domain breakdown
through the sample depth appears. The results obtained here are complementary
to the Landauer-Molotskii energetic approach.Comment: 35 pages, 8 figures, suplementary attached, to be submitted to Phys.
Rev.
Theory of structural response to macroscopic electric fields in ferroelectric systems
We have developed and implemented a formalism for computing the structural
response of a periodic insulating system to a homogeneous static electric field
within density-functional perturbation theory (DFPT). We consider the
thermodynamic potentials E(R,eta,e) and F(R,eta,e) whose minimization with
respect to the internal structural parameters R and unit cell strain eta yields
the equilibrium structure at fixed electric field e and polarization P,
respectively. First-order expansion of E(R,eta,e) in e leads to a useful
approximation in which R(P) and eta(P) can be obtained by simply minimizing the
zero-field internal energy with respect to structural coordinates subject to
the constraint of a fixed spontaneous polarization P. To facilitate this
minimization, we formulate a modified DFPT scheme such that the computed
derivatives of the polarization are consistent with the discretized form of the
Berry-phase expression. We then describe the application of this approach to
several problems associated with bulk and short-period superlattice structures
of ferroelectric materials such as BaTiO3 and PbTiO3. These include the effects
of compositionally broken inversion symmetry, the equilibrium structure for
high values of polarization, field-induced structural phase transitions, and
the lattice contributions to the linear and the non-linear dielectric
constants.Comment: 19 pages, with 15 postscript figures embedded. Uses REVTEX4 and epsf
macros. Also available at
http://www.physics.rutgers.edu/~dhv/preprints/sai_pol/index.htm
New Symmetries in Crystals and Handed Structures
For over a century, the structure of materials has been described by a
combination of rotations, rotation-inversions and translational symmetries. By
recognizing the reversal of static structural rotations between clockwise and
counterclockwise directions as a distinct symmetry operation, here we show that
there are many more structural symmetries than are currently recognized in
right- or left-handed handed helices, spirals, and in antidistorted structures
composed equally of rotations of both handedness. For example, though a helix
or spiral cannot possess conventional mirror or inversion symmetries, they can
possess them in combination with the rotation reversal symmetry. Similarly, we
show that many antidistorted perovskites possess twice the number of symmetry
elements as conventionally identified. These new symmetries predict new forms
for "roto" properties that relate to static rotations, such as rotoelectricity,
piezorotation, and rotomagnetism. They also enable symmetry-based search for
new phenomena, such as multiferroicity involving a coupling of spins, electric
polarization and static rotations. This work is relevant to structure-property
relationships in all material structures with static rotations such as
minerals, polymers, proteins, and engineered structures.Comment: 15 Pages, 4 figures, 3 Tables; Fig. 2b has error
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