Structure and dynamics of the interface between a binary hard-sphere crystal of NaCl type and its coexisting binary fluid

Molecular dynamics simulations are performed to study the [100] and [111] orientations of the crystal-melt interface between an ordered two-component hard sphere with a NaCl structure and its coexisting binary hard-sphere fluid. The diameter ratio of the two types of hard spheres making up the mixture is taken to be 0.414. This work complements our earlier interface simulations [J. Chem. Phys.116, 3410] for the same diameter ratio at lower pressures where the smaller component is immiscible in the solid and the fluid mixture coexists with a pure FCC crystal of large particles. Density profiles and diffusion coefficient profiles are presented for the AB interfacial system. We find that for this system, the transition from crystal-like to fluid-like behavior of both the density and diffusion constant profiles occurs over a narrower region than that seen in our previous studies [J. Chem. Phys. 116, 3410] of the FCC/binary fluid system. But similar to what was found in the FCC/binary fluid interface the transition region for the large particle diffusion constant is shifted about the size of the large particles toward the fluid phase relative to that for the small particles.Comment: 8 page

Environmental Benefits of Biochar

Understanding and improving environmental quality by reducing soil nutrient leaching losses, reducing bioavailability of environmental contaminants, sequestering C, reducing greenhouse gas emissions, and enhancing crop productivity in highly weathered or degraded soils, has been the goal of agroecosystem researchers and producers for years. Biochar, produced by pyrolysis of biomass, may help attain these goals. The desire to advance understanding of the environmental and agronomic implication of biochar utilization led to the organization of the 2010 ASA-CSSA-SSSA Environmental Quality Division session entitled Biochar Effects on the Environment and Agricultural Productivity (Long Beach, CA; Oct. 31-Nov. 3). Twenty-five presentations from this session, and sessions at the 2010 U.S. Biochar Initiative Conference (Ames, IA; June 27-30) and Biochar Symposium 2010 (organized by Dr. Bruno Glaser; University of Bayreuth, Bayreuth, Germany, July 8-9), make up a special collection of review and technical research papers focused on biochar creation and utilization. Individual contributions deal with improvement of the biochar knowledge base, current information gaps, and future biochar research needs. The prospect of biochar utilization is promising, as biochars may be custom designed for specific environmental applications

Adjusting the melting point of a model system via Gibbs-Duhem integration: application to a model of Aluminum

Model interaction potentials for real materials are generally optimized with respect to only those experimental properties that are easily evaluated as mechanical averages (e.g., elastic constants (at T=0 K), static lattice energies and liquid structure). For such potentials, agreement with experiment for the non-mechanical properties, such as the melting point, is not guaranteed and such values can deviate significantly from experiment. We present a method for re-parameterizing any model interaction potential of a real material to adjust its melting temperature to a value that is closer to its experimental melting temperature. This is done without significantly affecting the mechanical properties for which the potential was modeled. This method is an application of Gibbs-Duhem integration [D. Kofke, Mol. Phys.78, 1331 (1993)]. As a test we apply the method to an embedded atom model of aluminum [J. Mei and J.W. Davenport, Phys. Rev. B 46, 21 (1992)] for which the melting temperature for the thermodynamic limit is 826.4 +/- 1.3K - somewhat below the experimental value of 933K. After re-parameterization, the melting temperature of the modified potential is found to be 931.5K +/- 1.5K.Comment: 9 pages, 5 figures, 4 table

Interaction of quasilocal harmonic modes and boson peak in glasses

The direct proportionality relation between the boson peak maximum in glasses, $\omega_b$, and the Ioffe-Regel crossover frequency for phonons, $\omega_d$, is established. For several investigated materials $\omega_b = (1.5\pm 0.1)\omega_d$. At the frequency $\omega_d$ the mean free path of the phonons $l$ becomes equal to their wavelength because of strong resonant scattering on quasilocal harmonic oscillators. Above this frequency phonons cease to exist. We prove that the established correlation between $\omega_b$ and $\omega_d$ holds in the general case and is a direct consequence of bilinear coupling of quasilocal oscillators with the strain field.Comment: RevTex, 4 pages, 1 figur

Sensitive Radio-Frequency Measurements of a Quantum Dot by Tuning to Perfect Impedance Matching

Electrical readout of spin qubits requires fast and sensitive measurements, which are hindered by poor impedance matching to the device. We demonstrate perfect impedance matching in a radio-frequency readout circuit, using voltage-tunable varactors to cancel out parasitic capacitances. An optimized capacitance sensitivity of 1.6   aF / √ Hz is achieved at a maximum source-drain bias of 170 − μ V root-mean-square and with a bandwidth of 18 MHz. Coulomb blockade in a quantum-dot is measured in both conductance and capacitance, and the two contributions are found to be proportional as expected from a quasistatic tunneling model. We benchmark our results against the requirements for single-shot qubit readout using quantum capacitance, a goal that has so far been elusive

Maximum likelihood kernel density estimation: On the potential of convolution sieves

Methods for improving the basic kernel density estimator include variable locations, variable bandwidths and variable weights. Typically these methods are implemented separately and via pilot estimation of variation functions derived from asymptotic considerations. The starting point here is a simple maximum likelihood procedure which allows (in its greatest generality) variation of all these quantities at once, bypassing asymptotics and explicit pilot estimation. One special case of this approach is the density estimator associated with nonparametric maximum likelihood estimation (NPMLE) in a normal location mixture model. Another, closely associated with the NPMLE, is a kernel convolution sieve estimator proposed in 1982 but little used in practice to date. Simple algorithms are utilised, a simulation study is reported on, a method for bandwidth selection is investigated and an illustrative example is given. The simulations and other considerations suggest that the kernel convolution sieve provides an especially promising framework for further practical utilisation and development. And the method has a further advantage: it automatically reduces, where appropriate, to a few-component mixture model which indicates and initialises parametric mixture modelling of the data

Cross section measurements of the 3He(alpha, gamma) 7Be reaction using DRAGON at TRIUMF.

4 pags., 2 figs. -- Nuclear Physics in Astrophysics V 3–8 April 2011, Eilat, IsraelWe present our initial efforts with the DRAGON separator at TRIUMF facility towards obtaining the energy dependence of the astrophysical S-factor for 3He(¿, ¿)7Be reaction in the energy range of Ecm = 2 to 3 MeV that was recommended by the recent evaluations. A comparison between the existing data and our new complementary Madrid data, together with the recent theoretical calculations, is also given in the context of our ongoing work.This work has been supported by the UK STFC

First Observation of Coherent π0\pi^0 Production in Neutrino Nucleus Interactions with Eν<E_{\nu}< 2 GeV

The MiniBooNE experiment at Fermilab has amassed the largest sample to date of $\pi^0$s produced in neutral current (NC) neutrino-nucleus interactions at low energy. This paper reports a measurement of the momentum distribution of $\pi^0$s produced in mineral oil (CH$_2$) and the first observation of coherent $\pi^0$ production below 2 GeV. In the forward direction, the yield of events observed above the expectation for resonant production is attributed primarily to coherent production off carbon, but may also include a small contribution from diffractive production on hydrogen. Integrated over the MiniBooNE neutrino flux, the sum of the NC coherent and diffractive modes is found to be (19.5 $\pm$1.1 (stat) $\pm$2.5 (sys))% of all exclusive NC $\pi^0$ production at MiniBooNE. These measurements are of immediate utility because they quantify an important background to MiniBooNE's search for $\nu_{\mu} \to \nu_e$ oscillations.Comment: Submitted to Phys. Lett.

An Integrated TCGA Pan-Cancer Clinical Data Resource to Drive High-Quality Survival Outcome Analytics

For a decade, The Cancer Genome Atlas (TCGA) program collected clinicopathologic annotation data along with multi-platform molecular profiles of more than 11,000 human tumors across 33 different cancer types. TCGA clinical data contain key features representing the democratized nature of the data collection process. To ensure proper use of this large clinical dataset associated with genomic features, we developed a standardized dataset named the TCGA Pan-Cancer Clinical Data Resource (TCGA-CDR), which includes four major clinical outcome endpoints. In addition to detailing major challenges and statistical limitations encountered during the effort of integrating the acquired clinical data, we present a summary that includes endpoint usage recommendations for each cancer type. These TCGA-CDR findings appear to be consistent with cancer genomics studies independent of the TCGA effort and provide opportunities for investigating cancer biology using clinical correlates at an unprecedented scale. Analysis of clinicopathologic annotations for over 11,000 cancer patients in the TCGA program leads to the generation of TCGA Clinical Data Resource, which provides recommendations of clinical outcome endpoint usage for 33 cancer types