Formation of an Icosahedral Structure during the Freezing of Gold Nanoclusters: Surface-Induced Mechanism

The freezing behavior of gold nanoclusters was studied by employing molecular dynamics simulations based on a semi-empirical embedded-atom method. Investigations of the gold nanoclusters revealed that, just after freezing, ordered nano-surfaces with a fivefold symmetry were formed with interior atoms remaining in the disordered state. Further lowering of temperatures induced nano-crystallization of the interior atoms that proceeded from the surface towards the core region, finally leading to an icosahedral structure. These dynamic processes explain why the icosahedral cluster structure is dominantly formed in spite of its energetic metastability.Comment: 9 pages, 4 figures(including 14 eps-files

Hall effect in the normal state of high Tc cuprates

We propose a model for explaining the dependence in temperature of the Hall effect of high Tc cuprates in the normal state in various materials. They all show common features: a decrease of the Hall coefficient RH with temperature and a universal law, when plotting RH(T)/RH(T0) versus T/T0, where T0 is defined from experimental results. This behaviour is explained by using the well known electronic band structure of the CuO2 plane, showing saddle points at the energies ES in the directions (0,+/-pi) and (+/-pi,0). We remark that in a magnetic field, for energies E>ES the carrier orbits are hole-like and for E<ES they are electron-like, giving opposite contributions to RH. We are abble to fit the experimental results for a wide range of hole doping, and to fit the universal curve. For us kb*T0 is simply EF-ES, where EF is the Fermi level varying with the doping.Comment: 7 pages, 11 figure

Theoretical study of the thermal behavior of free and alumina-supported Fe-C nanoparticles

The thermal behavior of free and alumina-supported iron-carbon nanoparticles is investigated via molecular dynamics simulations, in which the effect of the substrate is treated with a simple Morse potential fitted to ab initio data. We observe that the presence of the substrate raises the melting temperature of medium and large $Fe_{1-x}C_x$ nanoparticles ($x$ = 0-0.16, $N$ = 80-1000, non- magic numbers) by 40-60 K; it also plays an important role in defining the ground state of smaller Fe nanoparticles ($N$ = 50-80). The main focus of our study is the investigation of Fe-C phase diagrams as a function of the nanoparticle size. We find that as the cluster size decreases in the 1.1-1.6-nm-diameter range the eutectic point shifts significantly not only toward lower temperatures, as expected from the Gibbs-Thomson law, but also toward lower concentrations of C. The strong dependence of the maximum C solubility on the Fe-C cluster size may have important implications for the catalytic growth of carbon nanotubes by chemical vapor deposition.Comment: 13 pages, 11 figures, higher quality figures can be seen in article 9 at http://alpha.mems.duke.edu/wahyu

The Haldane-Rezayi Quantum Hall State and Magnetic Flux

We consider the general abelian background configurations for the Haldane-Rezayi quantum Hall state. We determine the stable configurations to be the ones with the spontaneous flux of $(\Z+1/2) \phi_0$ with $\phi_0 = hc/e$. This gives the physical mechanism by which the edge theory of the state becomes identical to the one for the 331 state. It also provides a new experimental consequence which can be tested in the enigmatic $\nu=5/2$ plateau in a single layer system.Comment: RevTex, 5 pages, 2 figures. v2:minor corrections. v4: published version. Discussion on the thermodynamic limit adde

Charge ordering and chemical potential shift in La2−x_{2-x}Srx_xNiO4_4 studied by photoemission spectroscopy

We have studied the chemical potential shift in La$_{2-x}$Sr$_x$NiO$_4$ and the charge ordering transition in La$_{1.67}$Sr$_{0.33}$NiO$_4$ by photoemission spectroscopy. The result shows a large ($\sim$ 1 eV/hole) downward shift of the chemical potential with hole doping in the high-doping regime ($\delta \gtrsim$ 0.33) while the shift is suppressed in the low-doping regime ($\delta \lesssim$ 0.33). This suppression is attributed to a segregation of doped holes on a microscopic scale when the hole concentration is lower than $\delta \simeq 1/3$. In the $\delta = 1/3$ sample, the photoemission intensity at the chemical potential vanishes below the charge ordering transition temperature $T_{\rm CO}=$ 240 K.Comment: 5 pages, 4 figure

Electron-Like Fermi Surface and Remnant (pi,0) Feature in Overdoped La1.78Sr0.22CuO4

We have performed an angle-resolved photoemission study of overdoped La1.78Sr0.22CuO4, and have observed sharp nodal quasiparticle peaks in the second Brillouin zone that are comparable to data from Bi2Sr2CaCu2O8+d. The data analysis using energy distribution curves, momentum distribution curves and intensity maps all show evidence of an electron-like Fermi surface, which is well explained by band structure calculations. Evidence for many-body effects are also found in the substantial spectral weight remaining below the Fermi level around (pi,0), where the band is predicted to lie above EF.Comment: 4 pages, 4 figure

Effect of Stripes on Electronic States in Underdoped La_{2-x}Sr_xCuO_4

We investigate the electronic states of underdoped La_{2-x}Sr_xCuO_4 (LSCO) by using a microscopic model, i.e., t-t'-t''-J model, containing vertical charge stripes. The numerically exact diagonalization calculation on small clusters shows the consistent explanation of the physical properties in the angle-resolved photoemission, neutron magnetic scattering and optical conductivity experiments such as the antiphase domain and quasi-one-dimensional charge transport. The pair correlation function of the d-channel is suppressed by the stripes. These results demonstrate a crucial role of the stripes in LSCOComment: 4 pages, 4 EPS figures, revised version, to appear in Phys. Rev. Lett. Vol.82, No.25, 199

One-dimensional metallic behavior of the stripe phase in La2−x_{2-x}Srx_xCuO4_4

Using an exact diagonalization method within the dynamical mean-field theory we study stripe phases in the two-dimensional Hubbard model. We find a crossover at doping $\delta\simeq 0.05$ from diagonal stripes to vertical site-centered stripes with populated domain walls, stable in a broad range of doping, $0.05<\delta<0.17$. The calculated chemical potential shift $\propto -\delta^2$ and the doping dependence of the magnetic incommensurability are in quantitative agreement with the experimental results for doped La$_{2-x}$Sr$_x$CuO$_4$. The electronic structure shows one-dimensional metallic behavior along the domain walls, and explains the suppression of spectral weight along the Brillouin zone diagonal.Comment: 4 pages, 4 figure

Stripe structure, spectral feature and soliton gap in high Tc cuprates

We show that the lightly doped La_{2-x}Sr_{x}CuO_{4} can be described in terms of a stripe magnetic structure or soliton picture. The internal relationship between the recent neutron observation of the diagonal (x=0.05) to vertical (x >= 0.06) stripe transition, which was predicted, and the concomitant metal-insulator transition is clarified by this solitonic physics. The phase diagram with the unidentified transition lines between antiferromagnetic to stripe phases, the doping dependence of the modulation period, the origin of the mid-infrared optical absorption are investigated comparatively with other single layer systems: La_{2-x}Sr_{x}NiO_{4} and (La,Nd)_{2-x}Sr_{x}CuO_{4}. The novel type of quasi-particles and holes is fully responsible for metallic conduction and ultimately superconductivity.Comment: 4 pages RevTex, 5 figure