Electron localisation in static and time-dependent one-dimensional model systems

Electron localization is the tendency of an electron in a many-body system to exclude other electrons from its vicinity. Using a new natural measure of localization based on the exact manyelectron wavefunction, we find that localization can vary considerably between different ground-state systems, and can also be strongly disrupted, as a function of time, when a system is driven by an applied electric field. We use our new measure to assess the well-known electron localization function (ELF), both in its approximate single-particle form (often applied within density-functional theory) and its full many-particle form. The full ELF always gives an excellent description of localization, but the approximate ELF fails in time-dependent situations, even when the exact Kohn-Sham orbitals are employed.Comment: 7 pages, 4 figure

Energy versus electron transfer in organic solar cells: a comparison of the photophysics of two indenofluorene: fullerene blend films

In this paper, we compare the photophysics and photovoltaic device performance of two indenofluorene based polymers: poly[2,8-(6,6,12,12-tetraoctylindenofluorene)-co-4,7-(2,1,3-benzothiodiazole] (IF8BT) and poly[2,8-(6,6,12,12-tetraoctylindenofluorene)-co-5,5-(40,70-di-2-thienyl-20,10,30-benzothiodiazole] (IF8TBTT) blended with [6,6]-phenyl C61 butyric acid methyl ester (PCBM). Photovoltaic devices made with IF8TBTT exhibit greatly superior photocurrent generation and photovoltaic efficiency compared to those made with IF8BT. The poor device efficiency of IF8BT/PCBM devices is shown to result from efficient, ultrafast singlet F€orster energy transfer from IF8BT to PCBM, with the resultant PCBM singlet exciton lacking sufficient energy to drive charge photogeneration. The higher photocurrent generation observed for IF8TBTT/PCBM devices is shown to result from IF8TBTT’s relatively weak, red-shifted photoluminescence characteristics, which switches off the polymer to fullerene singlet energy transfer pathway. As a consequence, IF8TBTT singlet excitons are able to drive charge separation at the polymer/fullerene interface, resulting in efficient photocurrent generation. These results are discussed in terms of the impact of donor/acceptor energy transfer upon photophysics and energetics of charge photogeneration in organic photovoltaic\ud devices. The relevance of these results to the design of polymers for organic photovoltaic applications is also discussed, particularly with regard to explaining why highly luminescent polymers developed for organic light emitting diode applications often give relatively poor performance in organic photovoltaic devices

Towards brain-computer music interfaces: progress and challenges

Brain-Computer Music Interface (BCMI) is a new research area that is emerging at the cross roads of neurobiology,engineering sciences and music. This research involves three major challenging problems: the extraction of meaningful control information from signals emanating directly from the brain, the design of generative music techniques that respond to such information, and the training of subjects to use the system. We have implemented a proof-of-concept BCMI system that is able to use electroencephalogram information to generate music online. Ongoing research informed by a better understanding of brain activity associated with music cognition, and the development of new tools and techniques for implementing braincontrolled generative music systems offer a bright future for the development of BCMI

Linkage Disequilibrium Mapping via Cladistic Analysis of Single-Nucleotide Polymorphism Haplotypes

We present a novel approach to disease-gene mapping via cladistic analysis of single-nucleotide polymorphism (SNP) haplotypes obtained from large-scale, population-based association studies, applicable to whole-genome screens, candidate-gene studies, or fine-scale mapping. Clades of haplotypes are tested for association with disease, exploiting the expected similarity of chromosomes with recent shared ancestry in the region flanking the disease gene. The method is developed in a logistic-regression framework and can easily incorporate covariates such as environmental risk factors or additional unlinked loci to allow for population structure. To evaluate the power of this approach to detect disease-marker association, we have developed a simulation algorithm to generate high-density SNP data with short-range linkage disequilibrium based on empirical patterns of haplotype diversity. The results of the simulation study highlight substantial gains in power over single-locus tests for a wide range of disease models, despite overcorrection for multiple testing

Dynamics of the solar chromosphere. V. High-frequency modulation in ultraviolet image sequences from TRACE

We search for signatures of high-frequency oscillations in the upper solar photosphere and low chromosphere in the context of acoustic heating of outer stellar atmospheres. We use ultraviolet image sequences of a quiet center-disk area from the Transition Region and Coronal Explorer (TRACE) mission which were taken with strict cadence regularity. The latter permits more reliable high-frequency diagnosis than in earlier work. Spatial Fourier power maps, spatially averaged coherence and phase-difference spectra, and spatio-temporal k-f decompositions all contain high-frequency features that at first sight seem of considerable intrinsic interest but actually are more likely to represent artifacts of different nature. Spatially averaged phase difference measurement provides the most sensitive diagnostic and indicates the presence of acoustic modulation up to f=20 mHz (periods down to 50 seconds) in internetwork areas.Comment: 9 pages, 8 figure

Adaptation to Increasing Risks of Forest Fires

This work presents a quantitative assessment of adaptation options in the context of forest fires in Europe under projected climate change. A standalone fire model (SFM) based on a state-of-the-art, large-scale forest fire modeling algorithm is used to explore fuel removal through prescribed burnings and improved fire suppression as adaptation options. The climate change projections are provided by three climate models reflecting the SRES A2 scenario. The SFM’s modeled burned areas for selected test countries in Europe show satisfying agreement with observed data coming from two different sources (European Forest Fire Information System and Global Fire Emissions Database). Our estimation of the potential increase in burned areas in Europe under ‘‘no adaptation’’ scenario is about 200% by 2090 (compared with 2000-2008). The application of prescribed burnings has the potential to keep that increase below 50%. Improvements in fire suppression might reduce this impact even further, for example, boosting the probability of putting out a fire within a day by 10% would result in about a 30% decrease in annual burned areas. By taking more adaptation options into consideration, such as using agricultural fields as fire breaks, behavioral changes, and long-term options, burned areas can be potentially reduced even further

Combining measurements and modeling/simulations analysis to assess carbon nanotube memory cell characteristics

A simulation package for CNT memory cells is developed, based on computational modeling of both the mesoscopic structure of carbon nanotube films and the electrical conductivity of inter-CNT contacts. The developed package enables the modeling of various electrical measurements and identification of a range of operation conditions delivering desirable device characteristics. This approach opens the path for optimization of the CNT fabric to meet performance requirements