Simulating radiation damage in a bcc Fe system with embedded yttria nanoparticles

We present a molecular dynamics study of radiation damage arising from nuclear collisions close to embedded yttria nanoparticles in a bcc Fe matrix. The model assumes a perfect body-centred cubic (bcc) iron matrix in which yttria nano-particles are embedded as a simplified model of an Oxide Dispersion Strengthened steel. It is shown how the nano-particles interact with nearby initiated collision cascades, through cascade blocking and absorbing energy. Fe defects accumulate at the interface both directly from the ballistic collisions and also by attraction of defects generated close by. The nano-particles generally remain intact during a radiation event and release absorbed energy over times longer than the ballistic phase of the collision cascade

Persistence and Life Time Distribution in Coarsening Phenomen

We investigate the life time distribution in one and two dimensional coarsening processes modelled by Ising - Glauber dynamics at zero temperature. We find that the life time distribution obeys a scaling ansatz, asymptotically. An independent life time model where the life times are sampled from a distribution with power law tail is presented, which predicts analytically the qualitative features of the scaling function.Comment: 12 pages; 6 figure

Bound Pairs: Direct Evidence for Long-range Attraction between Like-Charged Colloids

We report observations of stable bound pairs in very dilute deionized aqueous suspensions of highly charged polystyrene colloidal particles, with monovalent counterions, using a confocal laser scanning microscope. Through an analysis of several thousands of time series of confocal images recorded deep inside the bulk suspension, we find that the measured pair-potential, U(r) has a long-range attractive component with well depths larger than the thermal energy. These observations provide a direct and unequivocal evidence for the existence of long-range attraction in U(r) of like-charged colloidal particles.Comment: 8 pages, 4 figures, submitted to Phys. Rev. Let

Electronic structure of Li2Pd3B and Li2Pt3B

Li2Pd3B is known to be superconducting, while the isotypical Li2Pt3B compound is not. Electronic structures of Li2Pd3B and Li2Pt3B have been calculated in order to obtain an insight into this surprising difference, through an analysis of the differences in the band structures. The electronic structures of these systems were obtained using the Full Potential Linear Augmented Plane Wave plus local orbitals (FP-LAPW+lo) method and it was found that four bands cross the Fermi level (EF). Out of these four bands, only two bands contribute significantly to the density of states at the EF. One of these bands is a hole band and the other an electron band. Thus at least a two-band model is required for studying the electronic properties of the Pd and Pt compounds. These two bands are rather narrow and hence the coulombic correlations effects can be significant.Comment: 18 pages, 8 figures, submitted to Physica

Simulating radiation damage in a bcc Fe system with embedded yttria nanoparticles

This paper was accepted for publication in the journal Journal of Nuclear Materials and the definitive published version is available at http://dx.doi.org/10.1016/j.jnucmat.2013.02.016We present a molecular dynamics study of radiation damage arising from nuclear collisions close to embedded yttria nanoparticles in a bcc Fe matrix. The model assumes a perfect body-centred cubic (bcc) iron matrix in which yttria nano-particles are embedded as a simplified model of an Oxide Dispersion Strengthened steel. It is shown how the nano-particles interact with nearby initiated collision cascades, through cascade blocking and absorbing energy. Fe defects accumulate at the interface both directly from the ballistic collisions and also by attraction of defects generated close by. The nano-particles generally remain intact during a radiation event and release absorbed energy over times longer than the ballistic phase of the collision cascade