968 research outputs found
Optical absorption spectra in fullerenes C60 and C70: Effects of Coulomb interactions, lattice fluctuations, and anisotropy
Effects of Coulomb interactions and lattice fluctuations in the optical
absorption spectra of C60 and C70 are theoretically investigated by using a
tight binding model with long-range Coulomb interaction and bond disorder.
Anisotropy effects in C70 are also considered. Optical spectra are calculated
by using the Hartree-Fock approximation followed by the configuration
interaction method. The main conclusions are as follows: (1) The broad peaks at
excitation energies, 3.7eV, 4.7eV, and 5.7eV, observed in experiments of C60
molecules in a solution are reasonably described by the present theory. Peak
positions and relative oscillator strengths are in overall agreement with the
experiments. The broadening of peaks by lattice fluctuations is well simulated
by the bond disorder model. (2) The optical gap of C70 is larger when the
electric field of light is parallel to the long axis of the molecule. The shape
of the frequency dispersion also depends on the orientation of the molecule.
These properties are common in the free electron model and the model with
Coulomb interactions. (3) The spectrum of C70 averaged over bond disorder and
random orientations is compared with experiments in a solution. There is an
overall agreement about the spectral shape. Differences in the spectra of C60
and C70 are discussed in connection with the symmetry reduction from a
soccerball to a rugbyball.Comment: PACS numbers: 78.66.Qn, 78.20.Dj, 71.35.+z, 31.20.Tz; LaTeX, 15
pages, 5 figures (Physical Review B); Note: Please request figures to
Authors. They will be sent via snail mai
Study of linear energy transfer effect on rib fracture in breast patients receiving pencil-beam-scanning proton therapy
Purpose: To study the effect of proton linear energy transfer (LET) on rib
fracture in breast cancer patients treated with pencil-beam scanning proton
therapy (PBS) using a novel tool of dose-LET volume histogram (DLVH).
Methods: From a prospective registry of patients treated with post-mastectomy
proton therapy to the chest wall and regional lymph nodes for breast cancer
between 2015 and 2020, we retrospectively identified rib fracture cases
detected after completing treatment. Contemporaneously treated control patients
that did not develop rib fracture were matched to patients 2:1 considering
prescription dose, boost location, reconstruction status, laterality, chest
wall thickness, and treatment year. The DLVH index, V(d, l), defined as
volume(V) of the structure with at least dose(d) and LET(l), was calculated.
DLVH plots between the fracture and control group were compared. Conditional
logistic regression (CLR) model was used to establish the relation of V(d, l)
and the observed fracture at each combination of d and l. The p-value derived
from CLR model shows the statistical difference between fracture patients and
the matched control group. Using the 2D p-value map, the DLVH features
associated with the patient outcomes were extracted.
Results: Seven rib fracture patients were identified, and fourteen matched
patients were selected for the control group. The median time from the
completion of proton therapy to rib fracture diagnosis was 12 months (range 5
to 14 months). Two patients had grade 2 symptomatic rib fracture while the
remaining 5 were grade 1 incidentally detected on imaging. The derived p-value
map demonstrated larger V(0-36 Gy[RBE], 4.0-5.0 keV/um) in patients
experiencing fracture (p<0.1).
Conclusions: In breast cancer patients receiving PBS, a larger volume of
chest wall receiving moderate dose and high LET may result in increased risk of
rib fracture.Comment: 1 Table and 3 Figure
Business process variant analysis based on mutual fingerprints of event logs
Comparing business process variants using event logs is a common use case in process mining. Existing techniques for process variant analysis detect statistically-significant differences between variants at the level of individual entities (such as process activities) and their relationships (e.g. directly-follows relations between activities). This may lead to a proliferation of differences due to the low level of granularity in which such differences are captured. This paper presents a novel approach to detect statistically-significant differences between variants at the level of entire process traces (i.e. sequences of directly-follows relations). The cornerstone of this approach is a technique to learn a directly-follows graph called mutual fingerprint from the event logs of the two variants. A mutual fingerprint is a lossless encoding of a set of traces and their duration using discrete wavelet transformation. This structure facilitates the understanding of statistical differences along the control-flow and performance dimensions. The approach has been evaluated using real-life event logs against two baselines. The results show that at a trace level, the baselines cannot always reveal the differences discovered by our approach, or can detect spurious differences.This research is partly funded by the Australian Research Council (DP180102839) and Spanish funds MINECO and FEDER (TIN2017-86727-C2-1-R).Peer ReviewedPostprint (author's final draft
Correlation property of length sequences based on global structure of complete genome
This paper considers three kinds of length sequences of the complete genome.
Detrended fluctuation analysis, spectral analysis, and the mean distance
spanned within time are used to discuss the correlation property of these
sequences. The values of the exponents from these methods of these three kinds
of length sequences of bacteria indicate that the long-range correlations exist
in most of these sequences. The correlation have a rich variety of behaviours
including the presence of anti-correlations. Further more, using the exponent
, it is found that these correlations are all linear (). It is also found that these sequences exhibit noise in some
interval of frequency (). The length of this interval of frequency depends
on the length of the sequence. The shape of the periodogram in exhibits
some periodicity. The period seems to depend on the length and the complexity
of the length sequence.Comment: RevTex, 9 pages with 5 figures and 3 tables. Phys. Rev. E Jan. 1,2001
(to appear
Tight-binding study of the influence of the strain on the electronic properties of InAs/GaAs quantum dots
We present an atomistic investigation of the influence of strain on the
electronic properties of quantum dots (QD's) within the empirical tight-binding (ETB) model with interactions up to 2nd nearest neighbors
and spin-orbit coupling. Results for the model system of capped pyramid-shaped
InAs QD's in GaAs, with supercells containing atoms are presented and
compared with previous empirical pseudopotential results. The good agreement
shows that ETB is a reliable alternative for an atomistic treatment. The strain
is incorporated through the atomistic valence force field model. The ETB
treatment allows for the effects of bond length and bond angle deviations from
the ideal InAs and GaAs zincblende structure to be selectively removed from the
electronic-structure calculation, giving quantitative information on the
importance of strain effects on the bound state energies and on the physical
origin of the spatial elongation of the wave functions. Effects of dot-dot
coupling have also been examined to determine the relative weight of both
strain field and wave function overlap.Comment: 22 pages, 7 figures, submitted to Phys. Rev. B (in press) In the
latest version, added Figs. 3 and 4, modified Fig. 5, Tables I and II,.and
added new reference
Measure representation and multifractal analysis of complete genomes
This paper introduces the notion of measure representation of DNA sequences.
Spectral analysis and multifractal analysis are then performed on the measure
representations of a large number of complete genomes. The main aim of this
paper is to discuss the multifractal property of the measure representation and
the classification of bacteria. From the measure representations and the values
of the spectra and related curves, it is concluded that these
complete genomes are not random sequences. In fact, spectral analyses performed
indicate that these measure representations considered as time series, exhibit
strong long-range correlation. For substrings with length K=8, the
spectra of all organisms studied are multifractal-like and sufficiently smooth
for the curves to be meaningful. The curves of all bacteria
resemble a classical phase transition at a critical point. But the 'analogous'
phase transitions of chromosomes of non-bacteria organisms are different. Apart
from Chromosome 1 of {\it C. elegans}, they exhibit the shape of double-peaked
specific heat function.Comment: 12 pages with 9 figures and 1 tabl
Characteristics of outdoor falls among older people: A qualitative study
Background Falls are a major threat to older people’s health and wellbeing. Approximately half of falls occur in outdoor environments but little is known about the circumstances in which they occur. We conducted a qualitative study to explore older people’s experiences of outdoor falls to develop understanding of how they may be prevented. Methods We conducted nine focus groups across the UK (England, Wales, and Scotland). Our sample was from urban and rural settings and different environmental landscapes. Participants were aged 65+ and had at least one outdoor fall in the past year. We analysed the data using framework and content analyses. Results Forty-four adults aged 65 – 92 took part and reported their experience of 88 outdoor falls. Outdoor falls occurred in a variety of contexts, though reports suggested the following scenarios may have been more frequent: when crossing a road, in a familiar area, when bystanders were around, and with an unreported or unknown attribution. Most frequently, falls resulted in either minor or moderate injury, feeling embarrassed at the time of the fall, and anxiety about falling again. Ten falls resulted in fracture, but no strong pattern emerged in regard to the contexts of these falls. Anxiety about falling again appeared more prevalent among those that fell in urban settings and who made more visits into their neighbourhood in a typical week. Conclusions This exploratory study has highlighted several aspects of the outdoor environment that may represent risk factors for outdoor falls and associated fear of falling. Health professionals are recommended to consider outdoor environments as well as the home setting when working to prevent falls and increase mobility among older people
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TRAC-BD1: transient reactor analysis code for boiling-water systems
The Boiling Water Reactor (BWR) version of the Transient Reactor Analysis Code (TRAC) is being developed at the Idaho National Engineering Laboratory (INEL) to provide an advanced best-estimate predictive capability for the analysis of postulated accidents in BWRs. The TRAC-BD1 program provides the Loss of Coolant Accident (LOCA) analysis capability for BWRs and for many BWR related thermal hydraulic experimental facilities. This code features a three-dimensional treatment of the BWR pressure vessel; a detailed model of a BWR fuel bundle including multirod, multibundle, radiation heat transfer, leakage path modeling capability, flow-regime-dependent constitutive equation treatment, reflood tracking capability for both falling films and bottom flood quench fronts, and consistent treatment of the entire accident sequence. The BWR component models in TRAC-BD1 are described and comparisons with data presented. Application of the code to a BWR6 LOCA is also presented
Aberrant miR-29 is a predictive feature of severe phenotypes in pediatric Crohn’s disease
Publisher PD
Models of coherent exciton condensation
That excitons in solids might condense into a phase-coherent ground state was
proposed about 40 years ago, and has been attracting experimental and
theoretical attention ever since. Although experimental confirmation has been
hard to come by, the concepts released by this phenomenon have been widely
influential. This tutorial review discusses general aspects of the theory of
exciton and polariton condensates, focussing on the reasons for coherence in
the ground state wavefunction, the BCS to Bose crossover(s) for excitons and
for polaritons, and the relationship of the coherent condensates to standard
lasers.Comment: 27 pages, 6 figures. Submitted for a special issue of J. Phys. Cond.
Matt. associated with the EU network "Photon-mediated phenomena in
semiconductor nanostructures
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