Volume 4; Issue 11

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ChemPhysChem
Volume 4; Issue 11

ChemPhysChem

Volume 4; Issue 11

1

QM/MM Car-Parrinello Molecular Dynamics Study of the Solvent Effects on the Ground State and on the First Excited Singlet State of Acetone in Water

Ute F. Röhrig, Irmgard Frank, Jürg Hutter, Alessandro Laio, Joost VandeVondele, Ursula Rothlisberger

Journal:

Year:

2003

Language:

english

File:

PDF, 131 KB

english, 2003

2

Low Temperature Conductance Measurements of Self-Assembled Monolayers of 1,4-Phenylene Diisocyanide

Christian J.-F. Dupraz, Udo Beierlein, Jörg P. Kotthaus

Journal:

Year:

2003

Language:

english

File:

PDF, 145 KB

english, 2003

3

Nanotubes à la Carte: Wetting of Porous Templates

Martin Steinhart, Joachim H. Wendorff, Ralf B. Wehrspohn

Journal:

Year:

2003

Language:

english

File:

PDF, 243 KB

english, 2003

4

Optimal Spectrum Estimation in Statistical Mechanics

Ralph A. Wheeler, Haitao Dong

Journal:

Year:

2003

Language:

english

File:

PDF, 84 KB

english, 2003

5

Conductance Properties of Stilbenoid Molecules

Rafael Gutiérrez, Frank Grossmann, Rüdiger Schmidt

Journal:

Year:

2003

Language:

english

File:

PDF, 124 KB

english, 2003

6

Aligned Nanotubes

Liming Dai, Ajeeta Patil, Xiaoyi Gong, Zhixin Guo, Luqi Liu, Yong Liu, Daoben Zhu

Journal:

Year:

2003

Language:

english

File:

PDF, 862 KB

english, 2003

7

Topological and Electron-Transfer Properties of Yeast Cytochrome c Adsorbed on Bare Gold Electrodes

Beatrice Bonanni, Dario Alliata, Anna Rita Bizzarri, Salvatore Cannistraro

Journal:

Year:

2003

Language:

english

File:

PDF, 169 KB

english, 2003

8

A Combined Atomic Force Microscopy and Molecular Dynamics Simulation Study on a Plastocyanin Mutant Chemisorbed on a Gold Surface

Anna Rita Bizzarri, Beatrice Bonanni, Giulio Costantini, Salvatore Cannistraro

Journal:

Year:

2003

Language:

english

File:

PDF, 184 KB

english, 2003

9

A High-speed Atomic Force Microscope for Studying Biological Macromolecules in Action

Toshio Ando, Noriyuki Kodera, Yasuyuki Naito, Tatsuya Kinoshita, Ken'ya Furuta, Yoko Y. Toyoshima

Journal:

Year:

2003

Language:

english

File:

PDF, 169 KB

english, 2003

10

Magneto-Optical Studies of HgTe/HgxCd1−xTe(S) Core–Shell Nanocrystals

Leonid Fradkin, Lidia Langof, Efrat Lifshitz, Andrey Rogach, Nikolai Gaponik, Horst Weller, Alex Eychmüller

Journal:

Year:

2003

Language:

english

File:

PDF, 197 KB

english, 2003

11

Theoretical Measurements of Conductance in an (AT)12 DNA Molecule

Tomofumi Tada, Masakazu Kondo, Kazunari Yoshizawa

Journal:

Year:

2003

Language:

english

File:

PDF, 151 KB

english, 2003

12

Organization of Water Layers at Hydrophilic Interfaces

Marc C. Gurau, Gibum Kim, Soon-Mi Lim, Fernando Albertorio, Helen C. Fleisher, Paul S. Cremer

Journal:

Year:

2003

Language:

english

File:

PDF, 95 KB

english, 2003

13

Additivity Effects in the Reactivities of Bimetallic Cluster Ions PtmAun+

Konrad Koszinowski, Detlef Schröder, Helmut Schwarz

Journal:

Year:

2003

Language:

english

File:

PDF, 98 KB

english, 2003

14

Electronic and Geometrical Structures of Cyclopropanes: Linear Correlation of Ionization Energies with CC Bond Lengths in Monosubstituted Cyclopropanes

Paul Rademacher

Journal:

Year:

2003

Language:

english

File:

PDF, 93 KB

english, 2003

15

Electrochemical Probing of Photochemical Reactions Inside Femtolitre Droplets Confined to Electrodes

Jay D. Wadhawan, Andrew J. Wain, Richard G. Compton

Journal:

Year:

2003

Language:

english

File:

PDF, 112 KB

english, 2003

16

Stationary Small and Large Amplitude Patterns during Bulk CO Electrooxidation on Platinum

Antoine Bonnefont, Hamilton Varela, Katharina Krischer

Journal:

Year:

2003

Language:

english

File:

PDF, 144 KB

english, 2003

17

Direct Voltammetric Evidence for a Reducing Agent Generated from the Electrochemical Oxidation of Tripropylamine for Electrochemiluminescence of Ruthenium Tris(bipyridine) Complexes?

Ming Zhou, Jürgen Heinze, Kai Borgwarth, Chander P. Grover

Journal:

Year:

2003

Language:

english

File:

PDF, 77 KB

english, 2003

18

Radical Ions from 3,3′′′,3′′′″-Tris(butylsulfanyl)-2,2′:5′,2″:5″,2′′′,5′′′,2′′′′:5′′′′,2′′′″-sexithiophene: An Experimental and Theoretical Study of the p- and n-Doped Oligomer

Angelo Alberti, Barbara Ballarin, Maurizio Guerra, Dante Macciantelli, Adele Mucci, Francesca Parenti, Luisa Schenetti, Renato Seeber, Chiara Zanardi

Journal:

Year:

2003

Language:

english

File:

PDF, 215 KB

english, 2003

19

Time-Resolved Second Harmonic Generation Near-Field Scanning Optical Microscopy

Richard D. Schaller, Justin C. Johnson, Richard J. Saykally

Journal:

Year:

2003

Language:

english

File:

PDF, 115 KB

english, 2003

20

Cover Picture: QM/MM Car-Parrinello Molecular Dynamics Study of the Solvent Effects on the Ground State and on the First Excited Singlet State of Acetone in Water (ChemPhysChem 11/2003)

Ute F. Röhrig, Irmgard Frank, Jürg Hutter, Alessandro Laio, Joost VandeVondele, Ursula Rothlisberger

Journal:

Year:

2003

Language:

english

File:

PDF, 23 KB

english, 2003

21

Graphical Abstract: ChemPhysChem 11/2003

Journal:

Year:

2003

Language:

english

File:

PDF, 225 KB

english, 2003

22

Ionic Liquid for in situ Vis/NIR and Raman Spectroelectrochemistry: Doping of Carbon Nanostructures

Ladislav Kavan, Lothar Dunsch

Journal:

Year:

2003

File:

PDF, 18 KB

2003

23

Book Review: Handbook of Machine Olfaction—Electronic Nose Technology. Editors T. C. Pearce, S. S. Schiffman, H. T. Nagle and J. W. Gardner

Andreas Schütze

Journal:

Year:

2003

Language:

english

File:

PDF, 55 KB

english, 2003

24

Book Review: Catalytic Air Pollution Control. By Ronald M. Heck and Robert J. Farrauto

Eric Godard, Johan Martens

Journal:

Year:

2003

Language:

english

File:

PDF, 40 KB

english, 2003

25

Book Review: Cohesion. A Scientific History of Intermolecular Forces. By J. S. Rowlinson

Journal:

Year:

2003

Language:

english

File:

PDF, 37 KB

english, 2003

26

Preview: ChemPhysChem 11/2003

Journal:

Year:

2003

File:

PDF, 87 KB

2003

27

Book Review: Interactions in Ultracold Gases. Editors Matthias Weidemüller and Claus Zimmermann

Alkwin Slenczka

Journal:

Year:

2003

Language:

english

File:

PDF, 52 KB

english, 2003

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