45,777 research outputs found
Strong electron correlations in cobalt valence tautomers
We have examined cobalt based valence tautomer molecules such as
Co(SQ)(phen) using density functional theory (DFT) and variational
configuration interaction (VCI) approaches based upon a model Hamiltonian. Our
DFT results extend earlier work by finding a reduced total energy gap (order
0.6 eV) between high temperature and low temperature states when we fully relax
the coordinates (relative to experimental ones). Futhermore we demonstrate that
the charge transfer picture based upon formal valence arguments succeeds
qualitatively while failing quantitatively due to strong covalency between the
Co 3 orbitals and ligand orbitals. With the VCI approach, we argue that
the high temperature, high spin phase is strongly mixed valent, with about 30 %
admixture of Co(III) into the predominantly Co(II) ground state. We confirm
this mixed valence through a fit to the XANES spectra. Moreover, the strong
electron correlations of the mixed valent phase provide an energy lowering of
about 0.2-0.3 eV of the high temperature phase relative to the low temperature
one. Finally, we use the domain model to account for the extraordinarily large
entropy and enthalpy values associated with the transition.Comment: 10 pages, 4 figures, submitted to J. Chem. Phy
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The Effect of Inkjet Ink Composition on Rheology And Jetting Behaviour
This work presents recent results on the way linear and non linear viscoelastic properties of the fluids affect the jetting
mechanism. Recent progress on quantitative characterising both high frequency linear (LVE) and non-linear (NLVE) viscoelasticity
of fluids allows fluids to be assessed for their jettability before using such materials in a DoD print head. In term of linear viscoelastic measurements, the Piezo Axial Vibrator (PAV) was used to probe the rheology of the fluids on a frequency range
between 10Hz and 10000Hz. A filament stretching apparatus, called the âCambridge Trimasterâ, was used in combination with
high speed cinematography, to characterize the fluids high speed stretching and break-up behaviour. The series of fluids investigated here consist in dilutions of mono disperse polystyrene with different molecular weight (110, 210, 306 and 488 kg/mol respectively) diluted in diethyl phthalate. The choice of polymer weights and concentrations were chosen to match both the
complex viscosity and the LVE. However, non linear rheological data experiments exhibit differences in the fluid relaxation time
and filament break-up mechanism. Ultra-high speed cinematography of DoD jetting events were correlated with filament break-up experiments and demonstrated that fluid rheology provides valuable information on the jetting quality of the fluids
Quasi-particle scattering and protected nature of topological states in a parent topological insulator BiSe
We report on angle resolved photoemission spectroscopic studies on a parent
topological insulator (TI), BiSe. The line width of the spectral
function (inverse of the quasi-particle lifetime) of the topological metallic
(TM) states shows an anomalous behavior. This behavior can be reasonably
accounted for by assuming decay of the quasi-particles predominantly into bulk
electronic states through electron-electron interaction and defect scattering.
Studies on aged surfaces reveal that topological metallic states are very much
unaffected by the potentials created by adsorbed atoms or molecules on the
surface, indicating that topological states could be indeed protected against
weak perturbations.Comment: accepted for publication in Phys. Rev. B(R
Transport in Graphene Tunnel Junctions
We present a technique to fabricate tunnel junctions between graphene and Al
and Cu, with a Si back gate, as well as a simple theory of tunneling between a
metal and graphene. We map the differential conductance of our junctions versus
probe and back gate voltage, and observe fluctuations in the conductance that
are directly related to the graphene density of states. The conventional
strong-suppression of the conductance at the graphene Dirac point can not be
clearly demonstrated, but a more robust signature of the Dirac point is found:
the inflection in the conductance map caused by the electrostatic gating of
graphene by the tunnel probe. We present numerical simulations of our
conductance maps, confirming the measurement results. In addition, Al causes
strong n-doping of graphene, Cu causes a moderate p-doping, and in high
resistance junctions, phonon resonances are observed, as in STM studies.Comment: 22 pages, 5 figure
Epitaxial growth and the magnetic properties of orthorhombic YTiO3 thin films
High-quality YTiO3 thin films were grown on LaAlO3 (110) substrates at low
oxygen pressures (<10-8 Torr) using pulsed laser deposition. The in-plane
asymmetric atomic arrangements at the substrate surface allowed us to grow
epitaxial YTiO3 thin films, which have an orthorhombic crystal structure with
quite different a- and b-axes lattice constants. The YTiO3 film exhibited a
clear ferromagnetic transition at 30 K with a saturation magnetization of about
0.7 uB/Ti. The magnetic easy axis was found to be along the [1-10] direction of
the substrate, which differs from the single crystal easy axis direction, i.e.,
[001].Comment: 14 pages, 4 figure
Spinor Dynamics in an Antiferromagnetic Spin-1 Condensate
We observe coherent spin oscillations in an antiferromagnetic spin-1
Bose-Einstein condensate of sodium. The variation of the spin oscillations with
magnetic field shows a clear signature of nonlinearity, in agreement with
theory, which also predicts anharmonic oscillations near a critical magnetic
field. Measurements of the magnetic phase diagram agree with predictions made
in the approximation of a single spatial mode. The oscillation period yields
the best measurement to date of the sodium spin-dependent interaction
coefficient, determining that the difference between the sodium spin-dependent
s-wave scattering lengths is Bohr radii.Comment: 5 pages, 2 figures. Changes: added reference, minor correction
Refugees, trauma and adversity-activated development
The nature of the refugee phenomenon is examined and the position of mental health professionals is located in relation to it. The various uses of the word 'trauma' are explored and its application to the refugee context is examined. It is proposed that refugees' response to adversity is not limited to being traumatized but includes resilience and Adversity-Activated Development (AAD). Particular emphasis is given to the distinction between resilience and AAD. The usefulness of the 'Trauma Grid' in the therapeutic process with refugees is also discussed. The Trauma Grid avoids global impressions and enables a more comprehensive and systematic way of identifying the individual refugee's functioning in the context of different levels, i.e. individual, family, community and society/culture. Finally, I discuss implications for therapeutic work with refugees
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