Search results for " clusters"
showing 10 items of 1091 documents
Are most of the stationary points in a molecular association minima? Application of Fraga's potential to benzene-benzene
1993
The importance of characterizing the stationary points of the intermolecular potential by means of Hessian eigenvalues is illustrated for the calculation of the benzene–benzene interaction using an atom-to-atom pair potential proposed by Fraga (FAAP). Two models, the standard one-center-per atom and another using three-centers-per atom due to Hunter and Sanders, are used to evaluate the electrostatic contributions and the results are compared. It is found in both cases that although using low-gradient thresholds allows optimization procedures to avoid many stationary points that are not true minima computing time considerations makes the usual procedure of using high-gradient thresholds [sa…
Study of single top production at high energy electron positron colliders
2014
The effect of single top production on the study of top quark pair production in future high energy electron--positron colliders is evaluated. The rate of the single top quark production process is sizeable throughout a large range of center-of-mass energies and cannot easily be distinguished from the dominant pair production process. We discuss the impact on the top quark mass extraction from a scan through the pair production threshold and the determination of top quark form factors in the continuum. These results advocate for the exploration of the inclusive $e^+e^-\rightarrow W^+bW^-\bar{b}$ process, that includes both top quark pair and single top quark production.
Forward-Backward and Charge Asymmetries in the Standard Model
2012
This talk reviews the Standard Model predictions for the top-quark forward backward and charge asymmetries measured at the Tevatron and at the LHC.
The Space Filling Dirichlet 3-Brane in N=2, D=4 Superspace
2001
We discuss a four-dimensional Volkov-Akulov supersymmetric theory on a D3-brane with N=2 supersymmetry broken down to N=1.
The interaction of surface plasmon polaritons with a silver film edge.
2001
A prism coupling arrangement is used to excite surface plasmons at the surface of a thin silver film and a photon scanning tunnelling microscope is used to detect the evanescent field above the silver surface. Excitation of the silver/air mode of interest is performed at lambda1 = 632.8 nm using a tightly focused beam, while the control of the tip is effected by exciting a counter-propagating surface plasmon field at a different wavelength, lambda2 = 543.5 nm, using an unfocused beam covering a macroscopic area. Propagation of the red surface plasmon is evidenced by an exponential tail extending away from the launch site, but this feature is abruptly truncated if the surface plasmon encount…
The next generation of laser spectroscopy experiments using light muonic atoms
2018
Precision spectroscopy of light muonic atoms provides unique information about the atomic and nuclear structure of these systems and thus represents a way to access fundamental interactions, properties and constants. One application comprises the determination of absolute nuclear charge radii with unprecedented accuracy from measurements of the 2S - 2P Lamb shift. Here, we review recent results of nuclear charge radii extracted from muonic hydrogen and helium spectroscopy and present experiment proposals to access light muonic atoms with Z ≥ 3. In addition, our approaches towards a precise measurement of the Zemach radii in muonic hydrogen (μp) and helium (μ 3He+) are discussed. These resul…
The “λ-medial axis”
2005
Medial axis is known to be unstable for nonsmooth objects. For an open set O, we define the weak feature size, wfs, minimum distance between Oc and the critical points of the function distance to Oc. We introduce the "lambda-medial axis" Mλ of O, a subset of the medial axis of O which captures the homotopy type of O when λ < wfs. We show that, at least for some "regular" values of λ, Mλ remains stable under Hausdorff distance perturbations of Oc.
Hepta- and tetra-nuclear copper(II) clusters self-assembled by cyano- and azacyano-carbanions
2015
International audience; Two polynuclear copper(II) complexes with hydroxido-bridging ligands and polycyanide units, [Cu{Cu(tn)}6(μ2-OH)2(μ3-OH)4Cl2](tcm)4Cl2·2H2O (1) and [{Cu(bpy)}4(OH)4(dca)2](dca)2·bpy·2H2O (2) (tn = NH2(CH2)3NH2; tcm− = [C(CN)3]−, bpy = 2,2′-bipyridyl, dca− = [N(CN)2]−) have been prepared by one-pot reactions. The structure of 1 consists of a centrosymmetric heptanuclear ion [Cu{Cu(tn)}6(μ2-OH)2(μ3-OH)4Cl2]6+. The tcm− and the halide anions which appear as counter-ions in the formula unit, play an important role in the stabilization of the complex since the hydrogen bonding between nitrogen atoms of the tcm− anion and halide anions, and hydrogen atoms of the terminal wa…
Atomic and electronic structure of hydrogen on ZnO (11̄00) surface: ab initio hybrid calculations
2013
Hydrogen atoms unavoidably incorporated into ZnO during growth of bulk samples and thin films considerably affect their electrical conductivity. The results of first principles hybrid LCAO calculations are discussed for hydrogen atoms in the bulk and on the non-polar ZnO (100) surface. The incorporation energy, the atomic relaxation, the electronic density redistribution and the electronic structure modifications are compared for the surface adsorption and bulk interstitial H positions. It is shown that hydrogen has a strong binding with the surface O ions (2.7 eV) whereas its incorporation into bulk is energetically unfavorable. Surface hydrogen atoms are very shallow donors, thus, contrib…
Pd–Pt alloys: correlation between electronic structure and hydrogenation properties
2001
Abstract Palladium and its alloys have been extensively studied because of their faculty to store reversibly hydrogen isotopes. Here, the substitution of palladium with platinum is investigated. Thermodynamical studies have shown an anomalous behaviour regarding to the classical models. This original behaviour is explained by the study of the electronic structure of the binary solid solutions. The drastic decrease of the hydrogen solubility in the Pd–Pt alloys is accounted for by the filling up of the palladium conduction band by the valence electrons of platinum. The anomalous decrease of the stability of the hydride is explained by the large broadening of the valence band due to the subst…