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Physical Review B

Volume 68, Issue 12

15 September 2003

Browse Issues:

RAPID COMMUNICATIONS

Electronic structure: wide-band, narrow-band, and strongly correlated systems

RAPID COMMUNICATION

Conductance switching in a molecular device: The role of side groups and intermolecular interactions

Jeremy Taylor, Mads Brandbyge, and Kurt Stokbro

Phys. Rev. B 68, 121101(R) (2003) - Published 12 September, 2003

Semiconductors I: bulk

RAPID COMMUNICATION

Dependence of the ionization energy of shallow donors and acceptors in silicon on the host isotopic mass

D. Karaiskaj, T. A. Meyer, M. L. W. Thewalt, and M. Cardona

Phys. Rev. B 68, 121201(R) (2003) - Published 16 September, 2003

Semiconductors II: surfaces, interfaces, microstructures, and related topics

RAPID COMMUNICATION

Applicability of the ergodicity hypothesis to mesoscopic fluctuations

O. Tsyplyatyev, I. L. Aleiner, Vladimir I. Fal’ko, and Igor V. Lerner

Phys. Rev. B 68, 121301(R) (2003) - Published 11 September, 2003

RAPID COMMUNICATION

Vertical confinement and evolution of reentrant insulating transition in the fractional quantum Hall regime

I. Yang, W. Kang, S. T. Hannahs, L. N. Pfeiffer, and K. W. West

Phys. Rev. B 68, 121302(R) (2003) - Published 11 September, 2003

RAPID COMMUNICATION

Indium phosphide (001)-(2×1): Direct evidence for a hydrogen-stabilized surface reconstruction

G. Chen, S. F. Cheng, D. J. Tobin, L. Li, K. Raghavachari, and R. F. Hicks

Phys. Rev. B 68, 121303(R) (2003) - Published 11 September, 2003

RAPID COMMUNICATION

Self-affine-like magnetoconductance fluctuations: Quasiperiodicity with a Weierstrass-like spectrum

A. Budiyono and K. Nakamura

Phys. Rev. B 68, 121304(R) (2003) - Published 12 September, 2003

RAPID COMMUNICATION

Elastic deformation blockade in a single-electron transistor

Norihiko Nishiguchi

Phys. Rev. B 68, 121305(R) (2003) - Published 16 September, 2003

Surface physics, low-dimensional systems, and related topics

RAPID COMMUNICATION

Geometry-based simulation of submonolayer film growth

Maozhi Li, M. C. Bartelt, and J. W. Evans

Phys. Rev. B 68, 121401(R) (2003) - Published 17 September, 2003

RAPID COMMUNICATION

Strongly size-dependent electronic properties in $C_{60}$ -encapsulated zigzag nanotubes and lower size limit of carbon nanopeapods

Jing Lu, Shigeru Nagase, Shuang Zhang, and Lianmao Peng

Phys. Rev. B 68, 121402(R) (2003) - Published 18 September, 2003

RAPID COMMUNICATION

Ordering of an incommensurate molecular layer with adsorbate-induced reconstruction: $C_{60} / Ag (100)$

Woei Wu Pai and Ching-Ling Hsu

Phys. Rev. B 68, 121403(R) (2003) - Published 29 September, 2003

ARTICLES

Electronic structure: wide-band, narrow-band, and strongly correlated systems

Calculated optical properties of $2 H - {MoS}_{2}$ intercalated with lithium

Ali Hussain Reshak and S. Auluck

Phys. Rev. B 68, 125101 (2003) - Published 2 September, 2003

Universal asymptotic behavior in flow equations of dissipative systems

Tobias Stauber

Phys. Rev. B 68, 125102 (2003) - Published 4 September, 2003

Role of dynamical polarization of the ligand-to-metal charge transfer excitations in ab initio determination of effective exchange parameters

Alain Gellé, Markéta L. Munzarová, Marie-Bernadette Lepetit, and Francesc Illas

Phys. Rev. B 68, 125103 (2003) - Published 8 September, 2003

Localization effects and inelastic scattering in disordered heavy electrons

M. C. O. Aguiar, E. Miranda, and V. Dobrosavljević

Phys. Rev. B 68, 125104 (2003) - Published 11 September, 2003

Non-Fermi-liquid behavior in a system with a nested Fermi surface

P. Schlottmann

Phys. Rev. B 68, 125105 (2003) - Published 12 September, 2003

Intra-atomic many-body effects in p-shell photoelectron spectra of ${Cr}^{3 +}$ ions

Eugene S. Ilton, Wibe A. deJong, and Paul S. Bagus

Phys. Rev. B 68, 125106 (2003) - Published 15 September, 2003

Metal-insulator transition in EuO

P. Sinjukow and W. Nolting

Phys. Rev. B 68, 125107 (2003) - Published 16 September, 2003

Anomalous 10-ns emission in ${Ce}^{3 +}$ -doped ${Cs}_{3} {LuCl}_{6}$

P. Dorenbos, E.V.D. van Loef, C.W.E. van Eijk, K.W. Krämer, and H.U. Güdel

Phys. Rev. B 68, 125108 (2003) - Published 22 September, 2003

Generalization of the shell model and correlation effects in strongly correlated oxides

A. S. Moskvin and Yu. D. Panov

Phys. Rev. B 68, 125109 (2003) - Published 26 September, 2003

Ab initio molecular dynamics calculations with simple, localized, orthonormal real-space basis sets

Yi Liu, Dawn A. Yarne, and Mark E. Tuckerman

Phys. Rev. B 68, 125110 (2003) - Published 29 September, 2003

Electronic structure of the quasi-one-dimensional organic conductor TTF-TCNQ

M. Sing, U. Schwingenschlögl, R. Claessen, P. Blaha, J. M. P. Carmelo, L. M. Martelo, P. D. Sacramento, M. Dressel, and C. S. Jacobsen

Phys. Rev. B 68, 125111 (2003) - Published 29 September, 2003

Ultrafast photoinduced reflectivity transients in $({Nd}_{0.5} {Sr}_{0.5}) {MnO}_{3}$

T. Mertelj, D. Mihailovic, Z. Jagličič, A. A. Bosak, O. Yu. Gorbenko, and A. R. Kaul

Phys. Rev. B 68, 125112 (2003) - Published 29 September, 2003

Spin-guide source for the generation of highly spin-polarized currents

R. N. Gurzhi, A. N. Kalinenko, A. I. Kopeliovich, A. V. Yanovsky, E. N. Bogachek, and Uzi Landman

Phys. Rev. B 68, 125113 (2003) - Published 29 September, 2003

Vacancy-induced half-metallicity in MnO and NiO

D. Ködderitzsch, W. Hergert, Z. Szotek, and W. M. Temmerman

Phys. Rev. B 68, 125114 (2003) - Published 30 September, 2003

Semiconductors I: bulk

Aggregation of carbon interstitials in silicon carbide: A theoretical study

A. Gali, P. Deák, P. Ordejón, N. T. Son, E. Janzén, and W. J. Choyke

Phys. Rev. B 68, 125201 (2003) - Published 8 September, 2003

Recombination of triplet excitons and polaron pairs in a derived paraphenylene vinylene pentamer

J. De Ceuster, E. Goovaerts, A. Bouwen, and V. Dyakonov

Phys. Rev. B 68, 125202 (2003) - Published 10 September, 2003

Structural, electronic, and magnetic properties of a ferromagnetic semiconductor: Co-doped ${TiO}_{2}$ rutile

W. T. Geng and Kwang S. Kim

Phys. Rev. B 68, 125203 (2003) - Published 12 September, 2003

Magnetic properties of substitutional $3 d$ transition metal impurities in silicon carbide

M. S. Miao and Walter R. L. Lambrecht

Phys. Rev. B 68, 125204 (2003) - Published 17 September, 2003

Quantum dynamics of polaron formation with the Wigner-function approach

Carlo Jacoboni, Rossella Brunetti, and Stefano Monastra

Phys. Rev. B 68, 125205 (2003) - Published 26 September, 2003

Limitations of electrical detection of x-ray absorption fine structure

J. Bollmann, S. Knack, J. Weber, V. Koteski, H.-E. Mahnke, and E. Welter

Phys. Rev. B 68, 125206 (2003) - Published 26 September, 2003

Long-range potential fluctuations and $1 / f$ noise in hydrogenated amorphous silicon

B. V. Fine, J. P. R. Bakker, and J. I. Dijkhuis

Phys. Rev. B 68, 125207 (2003) - Published 29 September, 2003

Nonexponential relaxation of photoinduced conductance in organic field effect transistors

Soumya Dutta and K. S. Narayan

Phys. Rev. B 68, 125208 (2003) - Published 29 September, 2003

Energy landscape of relaxed amorphous silicon

Francis Valiquette and Normand Mousseau

Phys. Rev. B 68, 125209 (2003) - Published 29 September, 2003

Transport coefficients from first-principles calculations

T. J. Scheidemantel, C. Ambrosch-Draxl, T. Thonhauser, J. V. Badding, and J. O. Sofo

Phys. Rev. B 68, 125210 (2003) - Published 29 September, 2003

Dilute nonisovalent (II-VI)-(III-V) semiconductor alloys: Monodoping, codoping, and cluster doping in ZnSe-GaAs

L. G. Wang and Alex Zunger

Phys. Rev. B 68, 125211 (2003) - Published 30 September, 2003

Electronic structure and transport in type-I and type-VIII clathrates containing strontium, barium, and europium

Georg K. H. Madsen, Karlheinz Schwarz, Peter Blaha, and David J. Singh

Phys. Rev. B 68, 125212 (2003) - Published 30 September, 2003

Semiconductors II: surfaces, interfaces, microstructures, and related topics

Lifetime of Wannier-Stark states in semiconductor superlattices under strong Zener tunneling to above-barrier bands

B. Rosam, K. Leo, M. Glück, F. Keck, H. J. Korsch, F. Zimmer, and K. Köhler

Phys. Rev. B 68, 125301 (2003) - Published 2 September, 2003

Raman characterization of strain and composition in small-sized self-assembled Si/Ge dots

P. H. Tan, K. Brunner, D. Bougeard, and G. Abstreiter

Phys. Rev. B 68, 125302 (2003) - Published 4 September, 2003

Correlation between overgrowth morphology and optical properties of single self-assembled InP quantum dots

M. K.-J. Johansson, U. Håkanson, M. Holm, J. Persson, T. Sass, J. Johansson, C. Pryor, L. Montelius, W. Seifert, L. Samuelson, and M.-E. Pistol

Phys. Rev. B 68, 125303 (2003) - Published 4 September, 2003

Electronic band structure of GaSe(0001): Angle-resolved photoemission and ab initio theory

L. Plucinski, R. L. Johnson, B. J. Kowalski, K. Kopalko, B. A. Orlowski, Z. D. Kovalyuk, and G. V. Lashkarev

Phys. Rev. B 68, 125304 (2003) - Published 5 September, 2003

Characterization of GaN quantum discs embedded in ${Al}_{x} {Ga}_{1 - x} N$ nanocolumns grown by molecular beam epitaxy

J. Ristić, E. Calleja, M. A. Sánchez-García, J. M. Ulloa, J. Sánchez-Páramo, J. M. Calleja, U. Jahn, A. Trampert, and K. H. Ploog

Phys. Rev. B 68, 125305 (2003) - Published 8 September, 2003

Homogeneous surface iron silicide formation on Si(111): The $c (8 \times 4)$ phase

M. Krause, F. Blobner, L. Hammer, K. Heinz, and U. Starke

Phys. Rev. B 68, 125306 (2003) - Published 8 September, 2003

Edge reconstruction in the fractional quantum Hall regime

Xin Wan, E. H. Rezayi, and Kun Yang

Phys. Rev. B 68, 125307 (2003) - Published 9 September, 2003

Coherent effects in spectrally resolved pump-probe differential reflectivity measurements at exciton resonance in GaAs quantum wells

Bipul Pal and A. S. Vengurlekar

Phys. Rev. B 68, 125308 (2003) - Published 10 September, 2003

Energy-dependent Huang-Rhys factor of free excitons

Hui Zhao and H. Kalt

Phys. Rev. B 68, 125309 (2003) - Published 11 September, 2003

Nanoindentation: Depth dependence of silicon hardness studied within contact theory

M. Hebbache

Phys. Rev. B 68, 125310 (2003) - Published 12 September, 2003

Light scattering on exciton resonance in a semiconductor quantum dot: Exact solution

S. V. Goupalov

Phys. Rev. B 68, 125311 (2003) - Published 12 September, 2003

Interference and zero-bias anomaly in tunneling between Luttinger-liquid wires

Yaroslav Tserkovnyak, Bertrand I. Halperin, Ophir M. Auslaender, and Amir Yacoby

Phys. Rev. B 68, 125312 (2003) - Published 16 September, 2003

Relaxation oscillations and dynamical enhancement of the breakdown hysteresis in quantum Hall systems with Corbino geometry

N. G. Kalugin, B. E. Saǧol, A. Buß, A. Hirsch, C. Stellmach, G. Hein, and G. Nachtwei

Phys. Rev. B 68, 125313 (2003) - Published 16 September, 2003

Photoemission study of clean and oxidized nonpolar $4 H - SiC$ surfaces

C. Virojanadara and L. I. Johansson

Phys. Rev. B 68, 125314 (2003) - Published 16 September, 2003

Thomas-Fermi-Poisson theory of screening for laterally confined and unconfined two-dimensional electron systems in strong magnetic fields

A. Siddiki and Rolf R. Gerhardts

Phys. Rev. B 68, 125315 (2003) - Published 16 September, 2003

Trion, biexciton, and exciton dynamics in single self-assembled CdSe quantum dots

B. Patton, W. Langbein, and U. Woggon

Phys. Rev. B 68, 125316 (2003) - Published 18 September, 2003

Intrasubband spin-flip relaxation by one-magnon processes in ${Cd}_{1 - x} {Mn}_{x} Te$ quantum wells

E. Souto, O. A. C. Nunes, F. M. S. Lima, D. A. Agrello, and A. L. A. Fonseca

Phys. Rev. B 68, 125317 (2003) - Published 18 September, 2003

Photoluminescence upconversion in colloidal CdTe quantum dots

Xiaoyong Wang, W. William Yu, Jiayu Zhang, Jose Aldana, Xiaogang Peng, and Min Xiao

Phys. Rev. B 68, 125318 (2003) - Published 22 September, 2003

Optical anisotropy in individual CdS quantum dot ensembles

Jifa Qi, Chuanbin Mao, John M. White, and Angela M. Belcher

Phys. Rev. B 68, 125319 (2003) - Published 24 September, 2003

Shot noise of coupled semiconductor quantum dots

G. Kießlich, A. Wacker, and E. Schöll

Phys. Rev. B 68, 125320 (2003) - Published 24 September, 2003

Electronic structure of SiC(0001) surfaces studied by two-photon photoemission

Michael Wiets, Martin Weinelt, and Thomas Fauster

Phys. Rev. B 68, 125321 (2003) - Published 24 September, 2003

Band-gap dependence of field emission from one-dimensional nanostructures grown on n-type and p-type silicon substrates

C. S. Chang, S. Chattopadhyay, L. C. Chen, K. H. Chen, C. W. Chen, Y. F. Chen, R. Collazo, and Z. Sitar

Phys. Rev. B 68, 125322 (2003) - Published 24 September, 2003

Atomic and electronic structure of the ${S i / S r T i O}_{3}$ interface

X. Zhang, A. A. Demkov, Hao Li, X. Hu, Yi Wei, and J. Kulik

Phys. Rev. B 68, 125323 (2003) - Published 26 September, 2003

Zero-phonon lines in the photoluminescence spectra of ${M g O : M n}^{2 +}$ nanocrystals

Igor S. Altman, Peter V. Pikhitsa, Mansoo Choi, Ho-Jun Song, Albert G. Nasibulin, and Esko I. Kauppinen

Phys. Rev. B 68, 125324 (2003) - Published 26 September, 2003

Carrier dynamics and intraminiband coupling in semiconductor superlattices

C. P. Holfeld, W. Schäfer, and K. Leo

Phys. Rev. B 68, 125325 (2003) - Published 26 September, 2003

Crossing of two Coulomb blockade resonances

Hans A. Weidenmüller

Phys. Rev. B 68, 125326 (2003) - Published 29 September, 2003

Quantum transport and integrability of the Anderson model for a quantum dot with multiple leads

Sam Young Cho, Huan-Qiang Zhou, and Ross H. McKenzie

Phys. Rev. B 68, 125327 (2003) - Published 29 September, 2003

Surface versus bulk contributions from reflectance anisotropy and electron energy loss spectra of the $GaAs (001) - c (4 \times 4)$ surface

F. Arciprete, C. Goletti, E. Placidi, P. Chiaradia, M. Fanfoni, F. Patella, C. Hogan, and A. Balzarotti

Phys. Rev. B 68, 125328 (2003) - Published 29 September, 2003

Weak localization and conductance fluctuations in a quantum dot with parallel magnetic field and spin-orbit scattering

Jan-Hein Cremers, Piet W. Brouwer, and Vladimir I. Fal’ko

Phys. Rev. B 68, 125329 (2003) - Published 29 September, 2003

Giant persistent current in a quantum ring with multiple arms

Han-Chun Wu, Yong Guo, Xin-Yi Chen, and Bing-Lin Gu

Phys. Rev. B 68, 125330 (2003) - Published 29 September, 2003

Nonlinear charging effect of quantum dots in a $p - i - n$ diode

G. Kießlich, A. Wacker, E. Schöll, S. A. Vitusevich, A. E. Belyaev, S. V. Danylyuk, A. Förster, N. Klein, and M. Henini

Phys. Rev. B 68, 125331 (2003) - Published 29 September, 2003

Electron spin polarization in resonant interband tunneling devices

A. G. Petukhov, D. O. Demchenko, and A. N. Chantis

Phys. Rev. B 68, 125332 (2003) - Published 29 September, 2003

Photoluminescence of CdSe self-assembled quantum dots: Experiments and models

R. A. Jones, Jan M. Yarrison-Rice, L. M. Smith, Howard E. Jackson, M. Dobrowolska, and J. K. Furdyna

Phys. Rev. B 68, 125333 (2003) - Published 30 September, 2003

Surface physics, low-dimensional systems, and related topics

Wetting transitions of hydrogen and deuterium on the surface of alkali metals

Wei Shi, J. Karl Johnson, and M. W. Cole

Phys. Rev. B 68, 125401 (2003) - Published 2 September, 2003

Chirality-dependent absorption and third-order polarizability spectra in open single-wall carbon nanotubes

D.-S. Wu, W.-D. Cheng, H. Zhang, X.-D. Li, Y.-Z. Lan, D.-G. Chen, Y.-J. Gong, and Y.-C. Zhang

Phys. Rev. B 68, 125402 (2003) - Published 8 September, 2003

First-principles study of adhesion at ${C u / S i O}_{2}$ interfaces

Kazutaka Nagao, J. B. Neaton, and N. W. Ashcroft

Phys. Rev. B 68, 125403 (2003) - Published 8 September, 2003

Perturbative approach for surface plasmon effects on flat interfaces periodically corrugated by subwavelength apertures

P. Lalanne, C. Sauvan, J. P. Hugonin, J. C. Rodier, and P. Chavel

Phys. Rev. B 68, 125404 (2003) - Published 9 September, 2003

Optimized surface-slab excited-state muffin-tin potential and surface core level shifts

J. Rundgren

Phys. Rev. B 68, 125405 (2003) - Published 10 September, 2003

Effects of the substrate on quantum well states: A first-principles study for Ag/Fe(100)

C. M. Wei and M. Y. Chou

Phys. Rev. B 68, 125406 (2003) - Published 11 September, 2003

Fe encapsulation by silicon clusters: Ab initio electronic structure calculations

Giannis Mpourmpakis, George E. Froudakis, Antonis N. Andriotis, and Madhu Menon

Phys. Rev. B 68, 125407 (2003) - Published 12 September, 2003

Scaling during shadowing growth of isolated nanocolumns

T. Karabacak, J. P. Singh, Y.-P. Zhao, G.-C. Wang, and T.-M. Lu

Phys. Rev. B 68, 125408 (2003) - Published 12 September, 2003

Electron–optical phonon interaction in carbon nanotubes

G. D. Mahan

Phys. Rev. B 68, 125409 (2003) - Published 16 September, 2003

Photoemission study of an ${N, N}^{'} - b i s - (1 - n a p h t h y l) - {N, N}^{'} - d i p h e n y l - 1, 1^{'} {- b i p h e n y l - 4, 4}^{'} - d i a m i n e$ overlayer on Ag(111)

B. Lu, H. J. Zhang, H. Y. Li, S. N. Bao, P. He, and T. L. Hao

Phys. Rev. B 68, 125410 (2003) - Published 16 September, 2003

Dimensional change as a function of charge injection in graphite intercalation compounds: A density functional theory study

Guangyu Sun, Miklos Kertesz, Jenõ Kürti, and Ray H. Baughman

Phys. Rev. B 68, 125411 (2003) - Published 22 September, 2003

Electron transmission through atom-contacted carbon nanotubes

L. F. Chibotaru, S. Compernolle, and A. Ceulemans

Phys. Rev. B 68, 125412 (2003) - Published 24 September, 2003

Carbon species confined inside carbon nanotubes: A density functional study

Yi Liu, R. O. Jones, Xinluo Zhao, and Yoshinori Ando

Phys. Rev. B 68, 125413 (2003) - Published 24 September, 2003

Maximum-entropy theory of steady-state quantum transport

P. Bokes and R. W. Godby

Phys. Rev. B 68, 125414 (2003) - Published 24 September, 2003

Tunneling measurement of quantum spin oscillations

L. N. Bulaevskii, M. Hruška, and G. Ortiz

Phys. Rev. B 68, 125415 (2003) - Published 26 September, 2003

Dynamical study on polaron formation in a metal/polymer/metal structure

C. Q. Wu, Y. Qiu, Z. An, and K. Nasu

Phys. Rev. B 68, 125416 (2003) - Published 26 September, 2003

Angle-resolved photoelectron spectroscopy study of the anion-derived dangling-bond band on $ZnO (101 ¯ 0)$

K. Ozawa, K. Sawada, Y. Shirotori, K. Edamoto, and M. Nakatake

Phys. Rev. B 68, 125417 (2003) - Published 26 September, 2003

Adsorption of atoms and fluids on spherical surfaces

E. Susana Hernandez, Milton W. Cole, and Massimo Boninsegni

Phys. Rev. B 68, 125418 (2003) - Published 26 September, 2003

Phase diagrams of surface plasmon polaritonic crystals

M. Kretschmann

Phys. Rev. B 68, 125419 (2003) - Published 26 September, 2003

Defective fullerenes and nanotubes as molecular magnets: An ab initio study

Yong-Hyun Kim, Jin Choi, K. J. Chang, and David Tománek

Phys. Rev. B 68, 125420 (2003) - Published 26 September, 2003

$H_{2}$ in the interstitial channels of nanotube bundles

M. C. Gordillo, J. Boronat, and J. Casulleras

Phys. Rev. B 68, 125421 (2003) - Published 29 September, 2003

Electrodynamics of spatial clusters of spheres: Substrate effects

Victor V. Gozhenko, Leonid G. Grechko, and Keith W. Whites

Phys. Rev. B 68, 125422 (2003) - Published 29 September, 2003

Influence of the spatial and temporal structure of the deposited-energy distribution in swift-ion-induced sputtering

M. Beuve, N. Stolterfoht, M. Toulemonde, C. Trautmann, and Herbert M. Urbassek

Phys. Rev. B 68, 125423 (2003) - Published 29 September, 2003

Energetics and electronic structures of one-dimensional fullerene chains encapsulated in zigzag nanotubes

Minoru Otani, Susumu Okada, and Atsushi Oshiyama

Phys. Rev. B 68, 125424 (2003) - Published 30 September, 2003

COMMENTS

Comment on “X-ray resonant scattering studies of orbital and charge ordering in $\Pr_{1 - x} {Ca}_{x} {MnO}_{3}$ ”

Joaquín García and Gloria Subías

Phys. Rev. B 68, 127101 (2003) - Published 26 September, 2003

Reply to “Comment on ‘X-ray resonant scattering studies of orbital and charge ordering in $\Pr_{1 - x} {Ca}_{x} {MnO}_{3}$ ’ ”

M. v. Zimmermann, S. Grenier, C. S. Nelson, J. P. Hill, Doon Gibbs, M. Blume, D. Casa, B. Keimer, Y. Murakami, C.-C. Kao, C. Venkataraman, T. Gog, Y. Tomioka, and Y. Tokura

Phys. Rev. B 68, 127102 (2003) - Published 26 September, 2003