Computations for the Nano-Scale

Abstract

Preface P.E. Bloechl, A.J. Fisher, C. Joachim. I: Surface physics and self-assembled monolayers. 1. Mesoscopic ordering from elastic and electrostatic interactions at surfaces D. Vanderbilt. 2. Chemical potential dependence of surface energetics J.E. Northrup. 3. Surface resistivity and atomic scale friction B.N.J. Persson. 4. Local probe investigation of self-assembled monolayers W. Mizutani, D. Anselmetti, B. Michel. 5. Monte Carlo studies of the microscopic properties of organic thin films J.I. Siepmann, I.R. McDonald. 6. First-principles studies of semiconductor surfaces: reconstruction and dissociative chemisorption I. Stich, M.C. Payne, A. DeVita, M.J. Gillan, L.J. Clarke. II: Aggregates and processes at interfaces. 7. Simulations of materials: clusters and interfacial junctions U. Landman, R.N. Barnett, H.-P. Cheng, C.L. Cleveland, W.D. Luedtke. 8. Stability, structure and melting of copper clusters K.W. Jacobsen, O.H. Nielsen, O.B. Christensen. 9. Structure and dynamics of confined fluids P.A. Thompson, M.O. Robbins, G.S. Grest. 10. Mechanical and electrical properties of metallic contacts A.P. Sutton, T.N. Todorov. III: Chemistry and molecular electron transfer. 11. Molecular and supramolecular self-assembly processes R.A. Bissell, J.F. Stoddart. 12. First-principles calculations of organometallic compounds P. Margl, K. Schwarz, P.E. Bloechl. 13. Electron transport through organic molecules with applications to molecular devices A. Broo. 14. Experimental long-range electron transfer andmolecular switch J.-P. Launay. IV: Scanning probes: STM and AFM. 15. Adsorption and STM imaging of organic molecules from first principles A.J. Fisher, P.E. Bloechl. 16. A continuum model for force microscopy force curve data N.A. Burnham. 17. Moving an adsorbate with the tip apex of a scanning probe microscope: a comparative study of the Xe-Cu(110) and Au-NaCl(100) systems C. Girard, X. Bouju, C. Joachim. 18. Dissociation of individual molecules with a STM G. Dujardin, R.E. Walkup, P. Avouris. V: Mesoscopic electron transport. 19. Computation of quantum-transport properties by random-matrix theory C.W.J. Beenakker. 20. Effect of the electromagnetic environment on single charge tunneling H. Grabert, G.-L. Ingold. 21. Single-electron tunneling through an ultra-small metal particle C. Schoenenberger. 22. Electron transport in open quantum systems W.R. Frensley, C. Fernando, J.R. Hellums, S. Venkata-Narasimhan. Index.