Reconstruction for Renal Artery Aneurysm and its Effect on Hypertension

AbstractObjectives: many renal artery aneurysms (RAA) are diagnosed incidentally in the course of investigations for hypertension and their management is controversial. Aim: to review the results of renal artery reconstruction for RAA. Methods: between January 1978 and December 1998 111 RAR were performed in 81 kidneys in 71 patients. Results: fifty-nine patients were hypertensive, three had a creatinine >2.0 mg/dl and one was on dialysis. The principal underlying pathology was fibromuscular dysplasia (39) and atherosclerosis (17). The mean RAA diameter was 2.2 (range 1–15) cm overall and 3.5 (range 2–10) cm in four patients who presented with rupture. Fifty-one patients had renal artery stenosis. Autogenous material was used in 105 RAR. There was no 30-day mortality and the morbidity rate was 16%. The 5-year cumulative patency rate was 69%. Hypertension was cured in 25% and improved in 39%.Conclusions: RAR tested for RAA treats hypertension and reduces the risk of rupture and distal embolisation

Finite-size version of the excitonic instability in graphene quantum dots

By a combination of Hartree-Fock simulations, exact diagonalization, and perturbative calculations, we investigate the ground-state properties of disorder-free circular quantum dots formed in a graphene monolayer. Taking the reference chemical potential at the Dirac point, we study N \leq 15 interacting particles, where the fine structure constant {\alpha} parametrizes the Coulomb interaction. We explore three different theoretical concepts: (i) Sucher's positive projection ("no-pair") approach, (ii) a more general Hamiltonian conserving both N and the number of additional electron-hole pairs, and (iii) the full quantum electrodynamics (QED) problem, where only N is conserved. We find that electron-hole pair production is important for {\alpha} 1. This corresponds to a reconstruction of the filled Dirac sea and is a finite-size version of the bulk excitonic instability. We also address the effects of an orbital magnetic field.Comment: 9 pages, 10 figures, to appear in PR

Sequential decoupling of negative-energy states in Douglas-Kroll-Hess theory

Here, we review the historical development, current status, and prospects of Douglas--Kroll--Hess theory as a quantum chemical relativistic electrons-only theory.Comment: 15 page

Reliable estimation of prediction uncertainty for physico-chemical property models

The predictions of parameteric property models and their uncertainties are sensitive to systematic errors such as inconsistent reference data, parametric model assumptions, or inadequate computational methods. Here, we discuss the calibration of property models in the light of bootstrapping, a sampling method akin to Bayesian inference that can be employed for identifying systematic errors and for reliable estimation of the prediction uncertainty. We apply bootstrapping to assess a linear property model linking the 57Fe Moessbauer isomer shift to the contact electron density at the iron nucleus for a diverse set of 44 molecular iron compounds. The contact electron density is calculated with twelve density functionals across Jacob's ladder (PWLDA, BP86, BLYP, PW91, PBE, M06-L, TPSS, B3LYP, B3PW91, PBE0, M06, TPSSh). We provide systematic-error diagnostics and reliable, locally resolved uncertainties for isomer-shift predictions. Pure and hybrid density functionals yield average prediction uncertainties of 0.06-0.08 mm/s and 0.04-0.05 mm/s, respectively, the latter being close to the average experimental uncertainty of 0.02 mm/s. Furthermore, we show that both model parameters and prediction uncertainty depend significantly on the composition and number of reference data points. Accordingly, we suggest that rankings of density functionals based on performance measures (e.g., the coefficient of correlation, r2, or the root-mean-square error, RMSE) should not be inferred from a single data set. This study presents the first statistically rigorous calibration analysis for theoretical Moessbauer spectroscopy, which is of general applicability for physico-chemical property models and not restricted to isomer-shift predictions. We provide the statistically meaningful reference data set MIS39 and a new calibration of the isomer shift based on the PBE0 functional.Comment: 49 pages, 9 figures, 7 table

Photocounting measurements with dead time and afterpulses in the continuous-wave regime

The widely used experimental technique of continuous-wave detection assumes counting pulses of photocurrent from a click-type detector inside a given measurement time window. With such a procedure we miss out the photons detected after each photocurrent pulse during the detector dead time. Additionally, each pulse may initialize so-called afterpulse, which is not associated with the real photons. We derive the corresponding quantum photocounting formula and experimentally verify its validity. Statistics of photocurrent pulses appears to be nonlinear with respect to quantum state, which is explained by the memory effect of the previous measurement time windows. Expressions -- in general, nonlinear -- connecting statistics of photons and pulses are derived for different measurement scenarios. We also consider an application of the obtained results to quantum state reconstruction with unbalanced homodyne detection.Comment: 23 pages, 19 figure

Semi- and Non-relativistic Limit of the Dirac Dynamics with External Fields

We show how to approximate Dirac dynamics for electronic initial states by semi- and non-relativistic dynamics. To leading order, these are generated by the semi- and non-relativistic Pauli hamiltonian where the kinetic energy is related to $\sqrt{m^2 + \xi^2}$ and $\xi^2 / 2m$, respectively. Higher-order corrections can in principle be computed to any order in the small parameter v/c which is the ratio of typical speeds to the speed of light. Our results imply the dynamics for electronic and positronic states decouple to any order in v/c << 1. To decide whether to get semi- or non-relativistic effective dynamics, one needs to choose a scaling for the kinetic momentum operator. Then the effective dynamics are derived using space-adiabatic perturbation theory by Panati et. al with the novel input of a magnetic pseudodifferential calculus adapted to either the semi- or non-relativistic scaling.Comment: 42 page

Considerations for a European animal welfare standard to evaluate adverse phenotypes in teleost fish

No abstract available

Entanglement Measures for Single- and Multi-Reference Correlation Effects

Electron correlation effects are essential for an accurate ab initio description of molecules. A quantitative a priori knowledge of the single- or multi-reference nature of electronic structures as well as of the dominant contributions to the correlation energy can facilitate the decision regarding the optimum quantum chemical method of choice. We propose concepts from quantum information theory as orbital entanglement measures that allow us to evaluate the single- and multi-reference character of any molecular structure in a given orbital basis set. By studying these measures we can detect possible artifacts of small active spaces.Comment: 14 pages, 4 figure