19,967 research outputs found
A scalable architecture for quantum computation with molecular nanomagnets
A proposal for a magnetic quantum processor that consists of individual
molecular spins coupled to superconducting coplanar resonators and transmission
lines is carefully examined. We derive a simple magnetic quantum
electrodynamics Hamiltonian to describe the underlying physics. It is shown
that these hybrid devices can perform arbitrary operations on each spin qubit
and induce tunable interactions between any pair of them. The combination of
these two operations ensures that the processor can perform universal quantum
computations. The feasibility of this proposal is critically discussed using
the results of realistic calculations, based on parameters of existing devices
and molecular qubits. These results show that the proposal is feasible,
provided that molecules with sufficiently long coherence times can be developed
and accurately integrated into specific areas of the device. This architecture
has an enormous potential for scaling up quantum computation thanks to the
microscopic nature of the individual constituents, the molecules, and the
possibility of using their internal spin degrees of freedom.Comment: 27 pages, 6 figure
Crystal lattice properties fully determine short-range interaction parameters for alkali and halide ions
Accurate models of alkali and halide ions in aqueous solution are necessary
for computer simulations of a broad variety of systems. Previous efforts to
develop ion force fields have generally focused on reproducing experimental
measurements of aqueous solution properties such as hydration free energies and
ion-water distribution functions. This dependency limits transferability of the
resulting parameters because of the variety and known limitations of water
models. We present a solvent-independent approach to calibrating ion parameters
based exclusively on crystal lattice properties. Our procedure relies on
minimization of lattice sums to calculate lattice energies and interionic
distances instead of equilibrium ensemble simulations of dense fluids. The gain
in computational efficiency enables simultaneous optimization of all parameters
for Li+, Na+, K+, Rb+, Cs+, F-, Cl-, Br-, and I- subject to constraints that
enforce consistency with periodic table trends. We demonstrate the method by
presenting lattice-derived parameters for the primitive model and the
Lennard-Jones model with Lorentz-Berthelot mixing rules. The resulting
parameters successfully reproduce the lattice properties used to derive them
and are free from the influence of any water model. To assess the
transferability of the Lennard-Jones parameters to aqueous systems, we used
them to estimate hydration free energies and found that the results were in
quantitative agreement with experimentally measured values. These
lattice-derived parameters are applicable in simulations where coupling of ion
parameters to a particular solvent model is undesirable. The simplicity and low
computational demands of the calibration procedure make it suitable for
parametrization of crystallizable ions in a variety of force fields.Comment: 9 pages, 5 table
Trends in antibacterial resistance among Streptococcus pneumoniae isolated in the USA: update from PROTEKT US Years 1–4
© 2008 Jenkins et al; licensee BioMed Central Ltd. This is an Open Access article distributed under the terms of the Creative Commons Attribution Licens
Bosonic Operator Methods for the Quark Model
Quark model matrix elements can be computed using bosonic operators and the
holomorphic representation for the harmonic oscillator. The technique is
illustrated for normal and exotic baryons for an arbitrary number of colors.
The computations are much simpler than those using conventional quark model
wavefunctions
Lifting of Ir{100} reconstruction by CO adsorption: An ab initio study
The adsorption of CO on unreconstructed and reconstructed Ir{100} has been
studied, using a combination of density functional theory and thermodynamics,
to determine the relative stability of the two phases as a function of CO
coverage, temperature and pressure. We obtain good agreement with
experimentaldata. At zero temperature, the (1X5) reconstruction becomes less
stable than the unreconstructed (1X1) surface when the CO coverage exceeds a
critical value of 0.09 ML. The interaction between CO molecules is found to be
repulsive on the reconstructed surface, but attractive on the unreconstructed,
explaining the experimental observation of high CO coverage on growing (1X1)
islands. At all temperatures and pressures, we find only two possible stable
states: 0.05 ML CO c(2X2) overlayer on the (1X1) substrate, and the clean
(15) reconstructed surface.Comment: 31 page
Electromagnetic Moments of the Baryon Decuplet
We compute the leading contributions to the magnetic dipole and electric
quadrupole moments of the baryon decuplet in chiral perturbation theory. The
measured value for the magnetic moment of the is used to determine
the local counterterm for the magnetic moments. We compare the chiral
perturbation theory predictions for the magnetic moments of the decuplet with
those of the baryon octet and find reasonable agreement with the predictions of
the large-- limit of QCD. The leading contribution to the quadrupole
moment of the and other members of the decuplet comes from one--loop
graphs. The pionic contribution is shown to be proportional to (and so
will not contribute to the quadrupole moment of nuclei), while the
contribution from kaons has both isovector and isoscalar components. The chiral
logarithmic enhancement of both pion and kaon loops has a coefficient that
vanishes in the limit. The third allowed moment, the magnetic octupole,
is shown to be dominated by a local counterterm with corrections arising at two
loops. We briefly mention the strange counterparts of these moments.Comment: Uses harvmac.tex, 15 pages with 3 PostScript figures packed using
uufiles. UCSD/PTH 93-22, QUSTH-93-05, Duke-TH-93-5
Shocks in supersonic sand
We measure time-averaged velocity, density, and temperature fields for steady
granular flow past a wedge and calculate a speed of granular pressure
disturbances (sound speed) equal to 10% of the flow speed. The flow is
supersonic, forming shocks nearly identical to those in a supersonic gas.
Molecular dynamics simulations of Newton's laws and Monte Carlo simulations of
the Boltzmann equation yield fields in quantitative agreement with experiment.
A numerical solution of Navier-Stokes-like equations agrees with a molecular
dynamics simulation for experimental conditions excluding wall friction.Comment: 4 pages, 5 figure
Effective field theory and the quark model
We analyze the connections between the quark model (QM) and the description
of hadrons in the low-momentum limit of heavy-baryon effective field theory in
QCD. By using a three-flavor-index representation for the effective baryon
fields, we show that the ``nonrelativistic'' constituent QM for baryon masses
and moments is completely equivalent through O(m_s) to a parametrization of the
relativistic field theory in a general spin--flavor basis. The flavor and spin
variables can be identified with those of effective valence quarks. Conversely,
the spin-flavor description clarifies the structure and dynamical
interpretation of the chiral expansion in effective field theory, and provides
a direct connection between the field theory and the semirelativistic models
for hadrons used in successful dynamical calculations. This allows dynamical
information to be incorporated directly into the chiral expansion. We find, for
example, that the striking success of the additive QM for baryon magnetic
moments is a consequence of the relative smallness of the non-additive
spin-dependent corrections.Comment: 25 pages, revtex, no figure
The 2s atomic level in muonic 208-Pb
Relative intensities and energy measurements of 2s level in muonic Pb-20
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