CO on Ru(001): Formation and dissolution of islands of CO at low coverages

The present paper deals with the benefits and difficulties of using ion scattering spectroscopy as a spectrometric technique

Effects of 3-d and 4-d-transition metal substitutional impurities on the electronic properties of CrO2

We present first-principles based density functional theory calculations of the electronic and magnetic structure of CrO2 with 3d (Ti through Cu) and 4d (Zr through Ag) substitutional impurities. We find that the half-metallicity of CrO2 remains intact for all of the calculated substitutions. We also observe two periodic trends as a function of the number of valence electrons: if the substituted atom has six or fewer valence electrons (Ti-Cr or Zr-Mo), the number of down spin electrons associated with the impurity ion is zero, resulting in ferromagnetic (FM) alignment of the impurity magnetic moment with the magnetization of the CrO2 host. For substituent atoms with eight to ten (Fe-Ni or Ru-Pd with the exception of Ni), the number of down spin electrons contributed by the impurity ion remains fixed at three as the number contributed to the majority increases from one to three resulting in antiferromagnetic (AFM) alignment between impurity moment and host magnetization. The origin of this variation is the grouping of the impurity states into 3 states with approximate "t2g" symmetry and 2 states with approximate "eg" symmetry. Ni is an exception to the rule because a Jahn-Teller-like distortion causes a splitting of the Ni eg states. For Mn and Tc, which have 8 valence electrons, the zero down spin and 3 down spin configurations are very close in energy. For Cu and Ag atoms, which have 11 valence electrons, the energy is minimized when the substituent ion contributes 5 Abstract down-spin electrons. We find that the interatomic exchange interactions are reduced for all substitutions except for the case of Fe for which a modest enhancement is calculated for interactions along certain crystallographic directions.Comment: 26 pages, 10 figures, 2 table

Magnetocaloric effect in Gd/W thin film heterostructures

In an effort to understand the impact of nanostructuring on the magnetocaloric effect, we have grown and studied gadolinium in MgO/W(50 $\textrm{\AA}$)/[Gd(400 $\textrm{\AA}$)/W(50 $\textrm{\AA}$)]$_8$ heterostructures. The entropy change associated with the second order magnetic phase transition was determined from the isothermal magnetization for numerous temperatures and the appropriate Maxwell relation. The entropy change peaks at a temperature of 284 K with a value of approximately 3.4 J/kg-K for a 0-30 kOe field change; the full width at half max of the entropy change peak is about 70 K, which is significantly wider than that of bulk Gd under similar conditions. The relative cooling power of this nanoscale system is about 240 J/kg, somewhat lower than that of bulk Gd (410 J/kg). An iterative Kovel-Fisher method was used to determine the critical exponents governing the phase transition to be $\beta=0.51$, and $\gamma=1.75$. Along with a suppressed Curie temperature relative to the bulk, the fact that the convergent value of $\gamma$ is that predicted by the 2-D Ising model may suggest that finite size effects play an important role in this system. Together, these observations suggest that nanostructuring may be a promising route to tailoring the magnetocaloric response of materials

Nonisentropic unsteady three dimensional small disturbance potential theory

Modifications that allow for more accurate modeling of flow fields when strong shocks are present were made into three dimensional transonic small disturbance (TSD) potential theory. The Engquist-Osher type-dependent differencing was incorporated into the solution algorithm. The modified theory was implemented in the XTRAN3S computer code. Steady flows over a rectangular wing with a constant NACA 0012 airfoil section and an aspect ratio of 12 were calculated for freestream Mach numbers (M) of 0.82, 0.84, and 0.86. The obtained results are compared using the modified and unmodified TSD theories and the results from a three dimensional Euler code are presented. Nonunique solutions in three dimensions are shown to appear for the rectangular wing as aspect ratio increases. Steady and unsteady results are shown for the RAE tailplane model at M = 0.90. Calculations using unmodified theory, modified theory and experimental data are compared

Start-to-end modelling of a mode-locked optical klystron free electron laser amplifier

A free electron laser (FEL) in a mode-locked optical klystron (MLOK) configuration is modelled using start-to-end simulations that simulate realistic electron beam acceleration and transport before input into a full three-dimensional FEL simulation code. These simulations demonstrate that the MLOK scheme is compatible with the present generation of radiofrequency accelerator designs. A train of few-optical cycle pulses is predicted with peak powers similar to those of the equivalent conventional FEL amplifier. The role of electron beam energy modulation in these results is explained and the limitations of some simulation codes discussed. It is shown how seeding the FEL interaction using a High Harmonic seed laser can improve the coherence properties of the output

Correlation length of hydrophobic polyelectrolyte solutions

The combination of two techniques (Small Angle X-ray Scattering and Atomic Force Microscopy) has allowed us to measure in reciprocal and real space the correlation length $\xi$ of salt-free aqueous solutions of highly charged hydrophobic polyelectrolyte as a function of the polymer concentration $C_p$, charge fraction $f$ and chain length $N$. Contrary to the classical behaviour of hydrophilic polyelectrolytes in the strong coupling limit, $\xi$ is strongly dependent on $f$. In particular a continuous transition has been observed from $\xi \sim C_p^{-1/2}$ to $\xi\sim C_p^{-1/3}$ when $f$ decreased from 100% to 35%. We interpret this unusual behaviour as the consequence of the two features characterising the hydrophobic polyelectrolytes: the pearl necklace conformation of the chains and the anomalously strong reduction of the effective charge fraction.Comment: 7 pages, 5 figures, submitted to Europhysics Letter

Hydrologic Transport of Dissolved Inorganic Carbon and Its Control on Chemical Weathering

Chemical weathering is one of the major processes interacting with climate and tectonics to form clays, supply nutrients to soil microorganisms and plants, and sequester atmospheric CO2. Hydrology and dissolution kinetics have been emphasized as factors controlling chemical weathering rates. However, the interaction between hydrology and transport of dissolved inorganic carbon (DIC) in controlling weathering has received less attention. In this paper, we present an analytical model that couples subsurface water and chemical molar balance equations to analyze the roles of hydrology and DIC transport on chemical weathering. The balance equations form a dynamical system that fully determines the dynamics of the weathering zone chemistry as forced by the transport of DIC. The model is formulated specifically for the silicate mineral albite, but it can be extended to other minerals, and is studied as a function of percolation rate and water transit time. Three weathering regimes are elucidated. For very small or large values of transit time, the weathering is limited by reaction kinetics or transport, respectively. For intermediate values, the system is transport controlled and is sensitive to transit time. We apply the model to a series of watersheds for which we estimate transit times and identify the type of weathering regime. The results suggest that hydrologic transport of DIC may be as important as reaction kinetics and dilution in determining chemical weathering rates

In-medium electron-nucleon scattering

In-medium nucleon electromagnetic form factors are calculated in the quark meson coupling model. The form factors are typically found to be suppressed as the density increases. For example, at normal nuclear density and $Q^2 \sim 0.3 { GeV}^2$, the nucleon electric form factors are reduced by approximately 8% while the magnetic form factors are reduced by only 1 - 2%. These variations are consistent with current experimental limits but should be tested by more precise experiments in the near future.Comment: 14 pages, latex, 3 figure