5,285 research outputs found
Accurate determination of crystal structures based on averaged local bond order parameters
Local bond order parameters based on spherical harmonics, also known as
Steinhardt order parameters, are often used to determine crystal structures in
molecular simulations. Here we propose a modification of this method in which
the complex bond order vectors are averaged over the first neighbor shell of a
given particle and the particle itself. As demonstrated using soft particle
systems, this averaging procedure considerably improves the accuracy with which
different crystal structures can be distinguished
Energy deposition studies for the High-Luminosity Large Hadron Collider inner triplet magnets
A detailed model of the High Luminosity LHC inner triplet region with new
large-aperture Nb3Sn magnets, field maps, corrector packages, and segmented
tungsten inner absorbers was built and implemented into the FLUKA and MARS15
codes. In the optimized configuration, the peak power density averaged over the
magnet inner cable width is safely below the quench limit. For the integrated
luminosity of 3000 fb-1, the peak dose in the innermost magnet insulator ranges
from 20 to 35 MGy. Dynamic heat loads to the triplet magnet cold mass are
calculated to evaluate the cryogenic capability. In general, FLUKA and MARS
results are in a very good agreement.Comment: 24 p
Energy Deposition Studies for the Hi-Lumi LHC Inner Triplet Magnets
A detailed model of the High Luminosity LHC inner triplet region with new
large-aperture Nb3Sn magnets, field maps, corrector packages, and segmented
tungsten inner absorbers was built and implemented into the FLUKA and MARS15
codes. In the optimized configuration, the peak power density averaged over the
magnet inner cable width is safely below the quench limit. For the integrated
luminosity of 3000 fb -1, the peak dose in the innermost magnet insulator
ranges from 20 to 35 MGy. Dynamic heat loads to the triplet magnet cold mass
are calculated to evaluate the cryogenic capability. In general, FLUKA and MARS
results are in a very good agreement.Comment: 4 pp. Presented paper at the 5th International Particle Accelerator
Conference, June 15 -20, 2014, Dresden, German
Direct determination of vibrational density of states change on ligand binding to a protein
The change in the vibrational density of states of a protein (dihydrofolate reductase) on binding a ligand (methotrexate) is determined using inelastic neutron scattering. The vibrations of the complex soften significantly relative to the unbound protein. The resulting free-energy change, which is directly determined by the density of states change, is found to contribute significantly to the binding equilibrium
Diffusive Josephson junctions made out of multiwalled carbon nanotubes
We have investigated electrical transport in diffusive multiwalled carbon nanotubes (MWNT) contacted using superconducting leads made of Ti/Al/Ti sandwich structure. We measure proximity-induced supercurrents up to Icm = 1.3 nA and find tunability by the gate voltage due to variation of the Thouless energy via the diffusion constant that is controlled by scattering in the MWNT. The modeling of these results by long, diffusive SNS junctions, supplemented with phase diffusion effects is discussed: the agreement between theory and experiments is tested especially on the basis of the temperature dependence of the Josephson coupling energy. In order to prove conclusively that the diffusive model works for MWNT proximity junctions, we propose an improved measurement scheme that is based on the kinetic inductance of superconducting junctions.Peer reviewe
Equilibrium free energies from fast-switching trajectories with large time steps
Jarzynski's identity for the free energy difference between two equilibrium
states can be viewed as a special case of a more general procedure based on
phase space mappings. Solving a system's equation of motion by approximate
means generates a mapping that is perfectly valid for this purpose, regardless
of how closely the solution mimics true time evolution. We exploit this fact,
using crudely dynamical trajectories to compute free energy differences that
are in principle exact. Numerical simulations show that Newton's equation can
be discretized to low order over very large time steps (limited only by the
computer's ability to represent resulting values of dynamical variables)
without sacrificing thermodynamic accuracy. For computing the reversible work
required to move a particle through a dense liquid, these calculations are more
efficient than conventional fast switching simulations by more than an order of
magnitude. We also explore consequences of the phase space mapping perspective
for systems at equilibrium, deriving an exact expression for the statistics of
energy fluctuations in simulated conservative systems
Tuning of structure inversion asymmetry by the -doping position in (001)-grown GaAs quantum wells
Structure and bulk inversion asymmetry in doped (001)-grown GaAs quantum
wells is investigated by applying the magnetic field induced photogalvanic
effect. We demonstrate that the structure inversion asymmetry (SIA) can be
tailored by variation of the delta-doping layer position. Symmetrically-doped
structures exhibit a substantial SIA due to impurity segregation during the
growth process. Tuning the SIA by the delta-doping position we grow samples
with almost equal degrees of structure and bulk inversion asymmetry.Comment: 4 pages 2 figure
Test Results on the Silicon Pixel Detector for the TTF-FEL Beam Trajectory Monitor
Test measurements on the silicon pixel detector for the beam trajectory
monitor at the free electron laser of the TESLA test facility are presented. To
determine the electronic noise of detector and read-out and to calibrate the
signal amplitude of different pixels the 6 keV photons of the manganese K line
are used. Two different methods determine the spatial accuracy of the detector:
In one setup a laser beam is focused to a straight line and moved across the
pixel structure. In the other the detector is scanned using a low-intensity
electron beam of an electron microscope. Both methods show that the symmetry
axis of the detector defines a straight line within 0.4 microns. The
sensitivity of the detector to low energy X-rays is measured using a vacuum
ultraviolet beam at the synchrotron light source HASYLAB. Additionally, the
electron microscope is used to study the radiation hardness of the detector.Comment: 14 pages (Latex), 13 figures (Postscript), submitted to Nuclear
Instruments and Methods
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