Case of Almost Redundant Components in 3 alpha Faddeev Equations

The 3 alpha orthogonality condition model using the Pauli-forbidden bound states of the Buck, Friedlich and Wheatly alpha alpha potential can yield a compact 3 alpha ground state with a large binding energy, in which a small admixture of the redundant components can never be eliminated.Comment: Revtex V4.0, 4 pages, no figure

Mononitration of durene

Reaction conditions under which the nitration of durene give predominantly, and in high yield, mononitrodurene (I), rather than dinitrodurene were found. The nitrating agent was No2+RF6-. Nitration with nitrosulfuric acid also gave mononitrodurene; however, byproducts such as 2.3.5.6-Me4C6HCH2C6H2Me3-2,4,5, were also formed. The NO2 PF6- gave an intermediate additional compound with durene. The reaction carried out with 3.6-dideuterodurene in D2O shows no isotope effect

Quark-Meson Coupling Model for a Nucleon

The quark-meson coupling model for a nucleon is considered. The model describes a nucleon as an MIT bag, in which quarks are coupled to scalar and vector mesons. A set of coupled equations for the quark and the meson fields are obtained and are solved in a self-consistent way. It is shown that the mass of a nucleon as a dressed MIT bag interacting with sigma- and omega-meson fields significantly differs from the mass of a free MIT bag. A few sets of model parameters are obtained so that the mass of a dressed MIT bag becomes the nucleon mass. The results of our calculations imply that the self-energy of the bag in the quark-meson coupling model is significant and needs to be considered in doing the nuclear matter calculations.Comment: 3 figure

Disorder-induced double resonant Raman process in graphene

An analytical study is presented of the double resonant Raman scattering process in graphene, responsible for the D and D$^{\prime}$ features in the Raman spectra. This work yields analytical expressions for the D and D$^{\prime}$ integrated Raman intensities that explicitly show the dependencies on laser energy, defect concentration, and electronic lifetime. Good agreement is obtained between the analytical results and experimental measurements on samples with increasing defect concentrations and at various laser excitation energies. The use of Raman spectroscopy to identify the nature of defects is discussed. Comparison between the models for the edge-induced and the disorder-induced D band intensity suggests that edges or grain boundaries can be distinguished from disorder by the different dependence of their Raman intensity on laser excitation energy. Similarly, the type of disorder can potentially be identified not only by the intensity ratio $I_{\mathrm{D}}/I_{\mathrm{D}^{\prime}}$, but also by its laser energy dependence. Also discussed is a quantitative analysis of quantum interference effects of the graphene wavefunctions, which determine the most important phonon wavevectors and scattering processes responsible for the D and D$^{\prime}$ bands.Comment: 10 pages, 4 figure

Energy Anomaly and Polarizability of Carbon Nanotubes

The energy of electron Fermi sea perturbed by external potential, represented as energy anomaly which accounts for the contribution of the deep-lying states, is analyzed for massive d = 1+1 Dirac fermions on a circle. The anomaly is a universal function of the applied field, and is related to known field-theoretic anomalies. We express transverse polarizability of Carbon nanotubes via the anomaly, in a way which exhibits the universality and scale-invariance of the response dominated by pi-electrons and qualitatively different from that of dielectric and conducting shells. Electron band transformation in a strong-field effect regime is predicted.Comment: 4 pg

Modeling of gas adsorption on graphene nanoribbons

We present a theory to study gas molecules adsorption on armchair graphene nanoribbons (AGNRs) by applying the results of \emph{ab} \emph{initio} calculations to the single-band tight-binding approximation. In addition, the effect of edge states on the electronic properties of AGNR is included in the calculations. Under the assumption that the gas molecules adsorb on the ribbon sites with uniform probability distribution, the applicability of the method is examined for finite concentrations of adsorption of several simple gas molecules (CO, NO, CO$_2$, NH$_3$) on 10-AGNR. We show that the states contributed by the adsorbed CO and NO molecules are quite localized near the center of original band gap and suggest that the charge transport in such systems cannot be enhanced considerably, while CO$_2$ and NH$_3$ molecules adsorption acts as acceptor and donor, respectively. The results of this theory at low gas concentration are in good agreement with those obtained by density-functional theory calculations.Comment: 7 pages, 6 figure

Observation of Devil's Staircase in the Novel Spin Valve System SrCo6_6O11_{11}

Using resonant soft x-ray scattering as a function of both temperature and magnetic field, we reveal a large number of almost degenerate magnetic orders in SrCo6O11. The Ising-like spins in this frustrated material in fact exhibit a so-called magnetic devil's staircase. It is demonstrated how a magnetic field induces transitions between different microscopic spin configurations, which is responsible for the magnetoresistance of SrCo6O11. This material therefore constitutes a unique combination of a magnetic devil's staircase and spin valve effects, yielding a novel type of magnetoresistance system.Comment: 5 pages, 5 figure

Optical matrix elements in tight-binding models with overlap

We investigate the effect of orbital overlap on optical matrix elements in empirical tight-binding models. Empirical tight-binding models assume an orthogonal basis of (atomiclike) states and a diagonal coordinate operator which neglects the intra-atomic part. It is shown that, starting with an atomic basis which is not orthogonal, the orthogonalization process induces intra-atomic matrix elements of the coordinate operator and extends the range of the effective Hamiltonian. We analyze simple tight-binding models and show that non-orthogonality plays an important role in optical matrix elements. In addition, the procedure gives formal justification to the nearest-neighbor spin-orbit interaction introduced by Boykin [Phys. Rev \textbf{B} 57, 1620 (1998)] in order to describe the Dresselahaus term which is neglected in empirical tight-binding models.Comment: 16 pages 6 figures, to appear in Phys. Rev.

Nonequilibrium quantum-impurities: from entropy production to information theory

Nonequilibrium steady-state currents, unlike their equilibrium counterparts, continuously dissipate energy into their physical surroundings leading to entropy production and time-reversal symmetry breaking. This letter discusses these issues in the context of quantum impurity models driven out of equilibrium by attaching the impurity to leads at different chemical potentials and temperatures. We start by pointing out that entropy production is often hidden in traditional treatments of quantum-impurity models. We then use simple thermodynamic arguments to define the rate of entropy production. Using the scattering framework recently developed by the authors we show that the rate of entropy production has a simple information theoretic interpretation in terms of the Shannon entropy and Kullback-Leibler divergence of nonequilibrium distribution function. This allows us to show that the entropy production is strictly positive for any nonequilibrium steady-state. We conclude by applying these ideas to the Resonance Level Model and the Kondo model.Comment: 5 pages, 1 figure new version with minor clarification

Properties of solar polar coronal plumes constrained by Ultraviolet Coronagraph Spectrometer data

We investigate the plasma dynamics (outflow speed and turbulence) inside polar plumes. We compare line profiles (mainly of \ion{O}{6}) observed by the UVCS instrument on SOHO at the minimum of solar cycle 22-23 with model calculations. We consider Maxwellian velocity distributions with different widths in plume and inter-plume regions. Electron densities are assumed to be enhanced in plumes and to approach inter-plume values with increasing height. Different combinations of the outflow and turbulence velocity in the plume regions are considered. We compute line profiles and total intensities of the \ion{H}{1} Ly$\alpha$ and the \ion{O}{6} doublets. The observed profile shapes and intensities are reproduced best by a small solar wind speed at low altitudes in plumes that increases with height to reach ambient inter-plume values above roughly 3-4 R_\sun combined with a similar variation of the width of the velocity distribution of the scattering atoms/ions. We also find that plumes very close to the pole give narrow profiles at heights above 2.5 R_\sun, which are not observed. This suggests a tendency for plumes to be located away from the pole. We find that the inclusion of plumes in the model computations provides an improved correspondence with the observations and confirms previous results showing that published UVCS observations in polar coronal holes can be roughly reproduced without the need for large temperature anisotropy. The latitude distributions of plumes and magnetic flux distributions are studied by analyzing data from different instruments on SOHO and with SOLIS.Comment: 11 figure