106 research outputs found
Electronic Characteristics of Quasi-2D Metallochloronitrides: Na(x)HfNCL (T_c=25 K)
Local density functional results are presented for the electron-doped
metallochloronitrides A(x)ZrNCl and A(x)HfNCl, A = Li or Na, which superconduct
up to 25K. The alkali non-stoichiometry is treated in a virtual crystal
approximation. The electronic structure is strongly two dimensional, especially
in the conduction band region occupied by the carriers, because the states are
formed from the in-plane orbitals d_xy, d_{x^2-y^2} of the metal ion and the
p_x, p_y orbitals of the N ion. We predict a change of behavior at a doping
level of x=0.3.Comment: To appear in Proc. HTS99 Conf., Miami 1999. Four revtex pages, 5
embedded postscript figure
On the Coexistence in RuSr2GdCu2O8 of Superconductivity and Ferromagnetism
We review the reasons that make superconductivity unlikely to arise in a
ferromagnet. Then, in light of the report by Tallon and collaborators that
RuSr2GdCu2O8 becomes superconducting at approximately 35 K which is well below
the Curie temperature of 132 K, we consider whether the objections really apply
to this compound. Our considerations are supported by local spin density
calculations for this compound, which indeed indicate a ferromagnetic RuO2
layer. The Ru moment resides in t_2g orbitals but is characteristic of
itinerant magnetism (and is sensitive to choice of exchange-correlation
potential and to the atomic positions). Based on the small exchange splitting
that is induced in the Cu-O layers, the system seems capable of supporting
singlet superconductivity an FFLO-type order parameter and possibly a pi-phase
alternation between layers. If instead the pairing is triplet in the RuO2
layers, it can be distinguished by a spin-polarized supercurrent. Either type
of superconductivity seems to imply a spontaneous vortex phase if the
magnetization is rotated out of the plane.Comment: 3 revtex pages, 2 embedded figures. In press, Proc. HTS99 Conf.,
Miami, 199
Magnetism in Atomic-Sized Palladium Contacts and Nanowires
We have investigated Pd nanowires theoretically, and found that, unlike
either metallic or free atomic Pd, they exhibit Hund's rule magnetism. In long,
monoatomic wires, we find a spin moment of 0.7 Bohr magnetons per atom, whereas
for short, monoatomic wires between bulk leads, the predicted moment is about
0.3 Bohr magnetons per wire atom. In contrast, a coaxial (6,1) wire was found
to be nonmagnetic. The origin of the wire magnetism is analyzed.Comment: 6 pages, including 4 figure
Mechanism for bipolar resistive switching in transition metal oxides
We introduce a model that accounts for the bipolar resistive switching
phenomenom observed in transition metal oxides. It qualitatively describes the
electric field-enhanced migration of oxygen vacancies at the nano-scale. The
numerical study of the model predicts that strong electric fields develop in
the highly resistive dielectric-electrode interfaces, leading to a spatially
inhomogeneous oxygen vacancies distribution and a concomitant resistive
switching effect. The theoretical results qualitatively reproduce non-trivial
resistance hysteresis experiments that we also report, providing key validation
to our model.Comment: Accepted for publication in Physical Review B, 6 twocolumn pages, 5
figure
First-Order Insulator-to-Metal Mott Transition in the Paramagnetic 3D System GaTa4Se8
The nature of the Mott transition in the absence of any symmetry braking
remains a matter of debate. We study the correlation-driven insulator-to-metal
transition in the prototypical 3D Mott system GaTa4Se8, as a function of
temperature and applied pressure. We report novel experiments on single
crystals, which demonstrate that the transition is of first order and follows
from the coexistence of two states, one insulating and one metallic, that we
toggle with a small bias current. We provide support for our findings by
contrasting the experimental data with calculations that combine local density
approximation with dynamical mean-field theory, which are in very good
agreement.Comment: 5 pages and 4 figures. Supplemental material: 2 pages, 2 figure
Interchain interactions and magnetic properties of Li2CuO2
An effective Hamiltonian is constructed for an insulating cuprate with
edge-sharing chains Li2CuO2.The Hamiltonian contains the nearest and
next-nearest neighboring intrachain and zigzag-type interchain interactions.The
values of the interactions are obtained from the analysis of the magnetic
susceptibility, and this system is found to be described as coupled frustrated
chains.We calculate the dynamical spin correlation function S(q,\omega) by
using the exact diagonalization method, and show that the spectra of
S(q,\omega) are characterized by the zigzag-type interchain interactions. The
results of the recent inelastic neutron scattering experiment are discussed in
the light of the calculated spectra.Comment: 4 pages, 3 figures, RevTe
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