The chemisorption of pentacene on Si(0 0 1)-2 × 1

Adsorption structures of the pentacene (C₂₂H₁₄) molecule on the clean Si(0 0 1)-2 × 1 surface were investigated by scanning tunneling microscopy (STM) in conjunction with density functional theory calculations and STM image simulations. The pentacene molecules were found to adsorb on four major sites and four minor sites. The adsorption structures of the pentacene molecules at the four major sites were determined by comparison between the experimental and the simulated STM images. Three out of the four theoretically identified adsorption structures are different from the previously proposed adsorption structures. They involve six to eight Si-C covalent chemical bonds. The adsorption energies of the major four structures are calculated to be in the range 67-128 kcal/mol. It was also found that the pentacene molecule hardly hopped on the surface when applying pulse bias voltages on the molecule, but was mostly decomposed.     

Anomalous bias dependence of spin torque in magnetic tunnel junctions

We predict an anomalous bias dependence of the spin transfer torque parallel to the interface, Tparallel, in magnetic tunnel junctions, which can be selectively tuned by the exchange splitting. It may exhibit a sign reversal without a corresponding sign reversal of the bias or even a quadratic bias dependence. We demonstrate that the underlying mechanism is the interplay of spin currents for the ferromagnetic (antiferromagnetic) configurations, which vary linearly (quadratically) with bias, respectively, due to the symmetric (asymmetric) nature of the barrier. The spin transfer torque perpendicular to interface exhibits a quadratic bias dependence.     

Local spectroscopy of image-potential-derived states: from single molecules to monolayers of benzene on Cu(111)

Stark-shifted image-potential states were measured with an STM tip for benzene adsorbed on a Cu(111) surface. A single benzene molecule locally shifts the position of the first image state toward the Fermi level by 0.2 eV relative to its position on the clean surface. The energetic position of this molecule-modified state shifts to lower energy with increasing coverage of benzene on the surface. This is attributed to local surface potential changes that are correlated with the lowering of the crystal work function due to adsorption of benzene.     

A Computational Study of CIONO2H+: Structure and Vibrations

Two protonated forms of chlorine nitrate, HClONO⁺ ₂ and ClONO₂H⁺, are treated ab initio by the Hartree-Fock and the second order Møller-Plesset perturbation approach with the standard 6–31G* basis set. Both minimum energy structures are planar (C ₃ symmetry) and their structural, energy, and vibrational parameters are reported. The computations conclude that the proton attacks the chlorine nitrate at its central, not end, oxygen atom. The protonation causes a considerable elongation of the central ON bond which becomes most probable place of cleavage. The dissociation should yield the neutral HOCl and NO⁺ ₂. These quantum-chemical findings well agree with the previous experimental indications.

     

Mass of the Bc meson in three-flavor lattice QCD

We use lattice QCD to predict the mass of the Bc meson. We use the MILC Collaboration's ensembles of lattice gauge fields, which have a quark sea with two flavors much lighter than a third. Our final result is mBc = 6304+/-12(+18)(-0) MeV. The first error bar is a sum in quadrature of statistical and systematic uncertainties, and the second is an estimate of heavy-quark discretization effects.     

High-speed addition/subtraction/complement/doubling of quaternary numbers using optical nonlinearities and DQPSK signals

We propose an innovative approach to implementing multiple arithmetic functions of quaternary numbers using optical nonlinearities and differential quadrature phase-shift keying (DQPSK) signals. By adopting 100 Gbit/s DQPSK signals (A, B) and exploiting nondegenerate four-wave mixing (FWM) for addition/subtraction and degenerate FWM for complement and doubling in a single highly nonlinear fiber, we demonstrate 50 Gbaud/s simultaneous quaternary addition (A+B), dual-directional subtraction (A-B, B-A), complement (-A, -B), and doubling (2B). Power penalties less than 4 dB (addition), 3 dB (dual-directional subtraction), 2 dB (complement), and 3.1 dB (doubling) are observed at a bit-error rate of 10(-9).     

Octave-spanning supercontinuum generation of vortices in an As2S3 ring photonic crystal fiber

We propose As(2)S(3) ring photonic crystal fiber (PCF) for supercontinuum generation of optical vortex modes. Due to the large material index contrast between As(2)S(3) and air holes in the designed ring PCF, there is a two-orders-of-magnitude improvement of the difference between the effective refractive indices of different vortex modes compared with regular ring fiber. The design freedom of PCFs enables a low dispersion (<60 ps/nm/km variation in total) over a 522 nm optical bandwidth. Moreover, the vortex mode has a large nonlinear coefficient of 11.7/W/m at 1550 nm with a small confinement loss of <0.03 dB/m up to 2000 nm. An octave-spanning supercontinuum spectrum of the vortex mode is generated from 1196 to 2418 nm at -20 dB by launching a 120 fs pulse with a 60 W peak power at 1710 nm into a 1 cm long As(2)S(3) ring PCF.     

Efficient generation and multiplexing of optical orbital angular momentum modes in a ring fiber by using multiple coherent inputs

We propose an approach to efficiently generate and multiplex optical orbital angular momentum (OAM) modes in a fiber with a ring refractive index profile by using multiple coherent inputs from a Gaussian mode. By controlling the phase relationship of the multiple inputs, one can selectively generate OAM modes of different states l. By controlling both the amplitude and phase of the multiple inputs, multiple OAM modes can be generated simultaneously without additional loss coming from multiplexing. We show, by simulation, the generation of OAM modes (OAM state |l|<3) with mode purity greater than 99%. The power loss of generating and multiplexing seven modes is about 35%. A transmitter for an OAM-based mode-division multiplexing system is proposed based on the discrete Fourier transform between the data carried by the multiple inputs and the data carried by the OAM modes. The experimental implementation of the proposed approach could be achieved by integrating ring fiber, multicore fiber, and photonic integrated circuit technology.     

Greenhouse gas abatement — toward Pareto-optimal decisions under uncertainty

This paper examines the economic logic of integrated assessment — balancing the costs against the benefits of greenhouse gas abatement. Stylized facts are employed in a multiregion computable general equilibrium model with a public good. The percentage shares of global emissions are determined outside the model — based upon some form of international agreement — and emission rights are tradeable between regions. The analysis is confined to Pareto-optimal (cooperative) solutions. We focus on the sensitivity of initial decisions to low-probability, high-consequence scenarios associated with cumulative emissions. For simplicity, there are only two regions, two tradeable goods, two time periods, and two states-of-world. With the particular form of public good model adopted here (production rather than utility function impacts), it turns out that a Pareto-optimal hedging strategy is indepedent of the emission shares allocated to each region. Equity issues may be separated from those of economic efficiency. Similar results extend to cases in which there are additional regions, tradeable goods, time periods, and states-of-world.Presented at the Conference on the Economics of Global Environmental Change, Birmingham University, May 9–11, 1994. This research was funded by the Electric Power Research Institute (EPRI). The views presented here are solely those of the individual authors, and do not necessarily represent the views of EPRI or its members.