3d-electron induced magnetic phase transition in half-metallic semi-Heusler alloys

We study the effect of the non-magnetic 3\textit{d} atoms on the magnetic properties of the half-metallic (HM) semi-Heusler alloys Co$_{1-x}$Cu$_{x}$MnSb and Ni$_{1-x}$Cu$_{x}$MnSb ($0 \leq x \leq 1$) using first-principles calculations. We determine the magnetic phase diagram of both systems at zero temperature and obtain a phase transition from a ferromagnetic to an antiferromagnetic state. For low Cu concentrations the ferromagnetic RKKY-like exchange mechanism is dominating, while the antiferromagnetic superexchange coupling becomes important for larger Cu content leading to the observed magnetic phase transition. A strong dependence of the magnetism in both systems on the position of the Fermi level within the HM gap is obtained. Obtained results are in good agreement with the available experimental data

Magnetism of mixed quaternary Heusler alloys: (Ni,T)2_{2}MnSn (T=Cu,Pd) as a case study

The electronic properties, exchange interactions, finite-temperature magnetism, and transport properties of random quaternary Heusler Ni$_{2}$MnSn alloys doped with Cu- and Pd-atoms are studied theoretically by means of {\it ab initio} calculations over the entire range of dopant concentrations. While the magnetic moments are only weakly dependent on the alloy composition, the Curie temperatures exhibit strongly non-linear behavior with respect to Cu-doping in contrast with an almost linear concentration dependence in the case of Pd-doping. The present parameter-free theory agrees qualitatively and also reasonably well quantitatively with the available experimental results. An analysis of exchange interactions is provided for a deeper understanding of the problem. The dopant atoms perturb electronic structure close to the Fermi energy only weakly and the residual resistivity thus obeys a simple Nordheim rule. The dominating contribution to the temperature-dependent resistivity is due to thermodynamical fluctuations originating from the spin-disorder, which, according to our calculations, can be described successfully via the disordered local moments model. Results based on this model agree fairly well with the measured values of spin-disorder induced resistivity.Comment: 13 pages, 13 figure

Ab-initio determined electronic and magnetic properties of half-metallic NiCrSi and NiMnSi Heusler alloys; the role of interfaces and defects

Using state-of-the-art first-principles calculations we study the properties of the ferromagnetic Heusler compounds NiYSi where Y stands for V, Cr or Mn. NiCrSi and NiMnSi contrary to NiVSi are half-metallic at their equilibrium lattice constant exhibiting integer values of the total spin magnetic moment and thus we concentrate on these two alloys. The minority-spin gap has the same characteristics as for the well-known NiMnSb alloy being around $\sim$1 eV. Upon tetragonalization the gap is present in the density of states even for expansion or contraction of the out-of-plane lattice parameter by 5%. The Cr-Cr and Mn-Mn interactions make ferromagnetism extremely stable and the Curie temperature exceeds 1000 K for NiMnSi. Surface and interfaces with GaP, ZnS and Si semiconductors are not half-metallic but in the case of NiCrSi the Ni-based contacts present spin-polarization at the Fermi level over 90%. Finally, we show that there are two cases of defects and atomic-swaps. The first-ones which involve the Cr(Mn) and Si atoms induce states at the edges of the gap which persists for a moderate-concentration of defects. Defects involving Ni atoms induce states localized within the gap completely destroying the half-metallicity. Based on single-impurity calculations we associate these states to the symmetry of the crystal

Establishing the potential for using routine data on Incapacity Benefit to assess the local impact of policy initiatives

<i>Background</i>: Incapacity Benefit (IB) is the key contributory benefit for people who are incapable of work because of illness or disability. <i>Methods</i>: The aims were to establish the utility of routinely collected data for local evaluation and to provide a descriptive epidemiology of the IB population in Glasgow and Scotland for the period 2000–05 using data supplied by the Department for Work and Pensions. <i>Results</i>: Glasgow's IB population is large in absolute and relative terms but is now falling, mainly due to a decrease in on flow. Claimants, tend to be older, have a poor work history and suffer from mental health problems. The rate of decline has been greater in Glasgow than Scotland, although the rate of on flow is still higher. <i>Conclusions</i>: Department for Work and Pensions (DWP) data can be used locally to provide important insights into the dynamics of the IB population. However, to be truly useful, more work needs to be undertaken to combine the DWP data with other information

Tracking the Orbital and Super-orbital Periods of SMC X-1

The High Mass X-ray Binary (HMXB) SMC X-1 demonstrates an orbital variation of 3.89 days and a super-orbital variation with an average length of 55 days. As we show here, however, the length of the super-orbital cycle varies by almost a factor of two, even across adjacent cycles. To study both the orbital and super-orbital variation we utilize lightcurves from the Rossi X-ray Timing Explorer All Sky Monitor (RXTE-ASM). We employ the orbital ephemeris from Wojdowski et al. (1998) to obtain the average orbital profile, and we show that this profile exhibits complex modulation during non-eclipse phases. Additionally, a very interesting ``bounceback'' in X-ray count rate is seen during mid-orbital eclipse phases, with a softening of the emission during these periods. This bounceback has not been previously identified in pointed observations. We then define a super-orbital ephemeris (the phase of the super-orbital cycle as a function of date) based on the ASM lightcurve and analyze the trend and distribution of super-orbital cycle lengths. SMC X-1 exhibits a bimodal distribution of these lengths, similar to what has been observed in other systems (e.g., Her X-1), but with more dramatic changes in cycle length. There is some hint, but not conclusive evidence, for a dependence of the super-orbital cycle length upon the underlying orbital period, as has been observed previously for Her X-1 and Cyg X-2. Using our super-orbital ephemeris we are also able to create an average super-orbital profile over the 71 observed cycles, for which we witness overall hardening of the spectrum during low count rate times. We combine the orbital and super-orbital ephemerides to study the correlation between the orbital and super-orbital variations in the system.Comment: 10 pages, using emulateapj style. To be published in the Astrophysical Journa

Isolation and characterisation of 17 microsatellite loci for the red-billed chough (Pyrrhocorax pyrrhocorax)

Peer reviewedPostprin

Surface Properties of the Half- and Full-Heusler Alloys

Using a full-potential \textit{ab-initio} technique I study the electronic and magnetic properties of the (001) surfaces of the half-Heusler alloys, NiMnSb, CoMnSb and PtMnSb and of the full-Heusler alloys Co$_2$MnGe, Co$_2$MnSi and Co$_2$CrAl. The MnSb terminated surfaces of the half-Heusler compounds present properties similar to the bulk compounds and, although the half-metallicity is lost, an important spin-polarisation at the Fermi level. In contrast to this the Ni terminated surface shows an almost zero net spin-polarisation. While the bulk Co$_2$MnGe and Co$_2$MnSi are almost half-ferromagnetic, their surfaces lose the half-metallic character and the net spin-polarisation at the Fermi level is close to zero. Contrary to these compounds the CrAl terminated (001) surface of Co$_2$CrAl shows a spin polarisation of about 84%.Comment: 14 pages, 6 figure

The Evolution of Radio Galaxies at Intermediate Redshift

We describe a new estimate of the radio galaxy 1.4 GHz luminosity function and its evolution at intermediate redshifts (z~0.4). Photometric redshifts and color selection have been used to select Bj<23.5 early-type galaxies from the Panoramic Deep Fields, a multicolor survey of two 25 sq deg fields. Approximately 230 radio galaxies have then been selected by matching early-type galaxies with NVSS radio sources brighter than 5 mJy. Estimates of the 1.4 GHz luminosity function of radio galaxies measure significant evolution over the observed redshift range. For an Omega_M=1 cosmology the evolution of the radio power is consistent with luminosity evolution where P(z)=P(0)(1+z)^{k_L} and 3<k_L<5. The observed evolution is similar to that observed for UVX and X-ray selected AGN and is consistent with the same physical process being responsible for the optical and radio luminosity evolution of AGN.Comment: 26 pages, 9 Figures, Accepted for Publication in A

Polyaryl ethers and related polysiloxane copolymer molecular coatings preparation and radiation degrdation

Poly(arylene ether sulfones) comprise a class of materials known as engineering thermoplastics which have a variety of important applications. These polymers are tough, rigid materials with good mechanical properties over a wide temperature range, and they are processed by conventional methods into products typically having excellent hydrolytic, thermal, oxidative and dimensional stability. Wholly aromatic random copolymers of hydroquinone and biphenol with 4.4 prime dichlorodiphenyl sulfone were synthesized via mechanical nucleophilic displacement. Their structures were characterized and mechanical behavior studied. These tough, ductile copolymers show excellent radiation resistance to electron beam treatment and retain much of the mechanical properties up to at least 700 Mrads under argon