Fritz-Haber-Institut der Max-Planck-Gesellschaft  

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40. Excitation Spectra and Ground-state Properties from Density-functional Theory for the Inverted Band-structure Systems beta-HgS, HgSe, and HgTe
A. Delin, Th. Klüner
Journal: Phys. Rev. B - Condensed Matter and Materials Physics, Volume: 66, Page: 035117-1-8, Year: 2002
39. XPEEM with Energy-Filtering: Advantages and First Results from the Smart Project
Th. Schmidt, U. Groh, R. Fink, E. Umbach, O. Schaff, W. Engel, B. Richter, H. Kuhlenbeck, R. Schlögl, H.-J. Freund, A.M. Bradshaw, D. Preikszas, P. Hartel, R. Spehr, H. Rose, G. Lilienkamp, E. Bauer, G. Benner
Journal: Surface Review and Letters, Volume: 9, Page: 223-232, Year: 2002
38. Model Systems for Heterogeneous Catalysis: Quo Vadis Surface Science
H.-J. Freund, N. Ernst, M. Bäumer, G. Rupprechter, J. Libuda, H. Kuhlenbeck, T. Risse, W. Drachsel, K. Al-Shamery, H. Hamann
Journal: Surface Chemistry and Catalysis, Page: 103-141, Year: 2002
37. Vibrational Spectroscopy and Imaging of Single Molecules: Bonding of CO to Single Pd Atoms on NiAl(110)
N. Nilius, T. M. Wallis, W. Ho
Journal: J. Chem. Phys., Volume: 117, Page: 10947, Year: 2002
36. Reply to the Comment on "Prediction of Electronic Excited States of Adsorbates on Metal Surfaces from First Principles"
Th. Klüner, N. Govind, Y. A. Wang, E. A. Carter
Journal: Phys. Rev. Lett., Volume: 88, Page: 209701, Year: 2002
35. Periodic Density Functional Embedding Theory for Complete Active Space Self-consistent Field and Configuration Interaction Calculations: Ground and Excited States
Th. Klüner, N. Govind, Y. A. Wang, E. A. Carter
Journal: J. Chem. Phys., Volume: 116, Page: 42, Year: 2002
34. A Complete Quantum Description of an ultrafast Pump-Probe Charge Transfer Event in Condensed Phase
C. P. Koch, Th. Klüner, R. Kosloff
Journal: J. Chem. Phys., Volume: 116, Page: 7983, Year: 2002
33. Adsorption, Decomposition and Oxidation of Methanol on Alumina Supported Pd Nanoparticles
S. Schauermann, J. Hoffmann, V. Johánek, J. Hartmann, J. Libuda
Journal: Phys. Chem. Chem. Phys., Volume: 4, Page: 3909, Year: 2002
32. The Molecular Origins of Selectivity in Methanol Decomposition on Pd Nanoparticles
S. Schauermann, J. Hoffmann, V. Johánek, J. Hartmann, J. Libuda, H.-J. Freund
Journal: Catal. Lett., Volume: 84, Page: 209-217, Year: 2002
31. Model Catalysts Studies on Vanadia Particles Deposited onto a Thin Film Alumina Support: 1. Structural Properties
N. Magg, J. B. Giorgi, T. Schroeder, M. Bäumer, H.-J. Freund
Journal: J. Phys. Chem. B, Volume: 106, Page: 8756-8761, Year: 2002
30. Direkte Beobachtung von Radikalen bei der Aktivierung von Ziegler-Natta-Katalysatoren
T. Risse, J. Schmidt, H. Hamann, H.-J. Freund
Journal: Angew. Chem., Volume: 114, Page: 1587-1591, Year: 2002
29. Characterization of a Model Ziegler-Natta Catalyst for Ethylene Polymerization
J. Schmidt, T. Risse. H. Hamann, H.-J. Freund
Journal: J. Chem. Phys., Volume: 116, Page: 10861-10868, Year: 2002
28. Sum Frequency Generation Vibrational Spectroscopy at Solid-Gas Interfaces: CO Adsorption on Pd Model Catalysts at High Pressure
G. Rupprechter, H. Unterhalt, M. Morkel, P. Galletto, L. Hu, H.-J. Freund
Journal: Surf. Sci., Volume: 502-503, Page: 109-122, Year: 2002
27. Surface Photochemistry on Confined Systems: UV-laser-induced Photodesorption of NO from Pd-nanostructures on Al2O3
M. Kampling, K. Al-Shamery, H.-J. Freund, M. Wilde, K. Fukutani, Y. Murata
Journal: Phys. Chem. Chem. Phys., Volume: 4, Page: 2629-2637, Year: 2002
26. Morphological and Electronic Properties of Ultrathin Crystalline Silica Epilayers on a Mo(112) Substrate
T. Schroeder, J. Giorgi, M. Bäumer, H.-J. Freund
Journal: Phys. Rev. B, Volume: 66, Page: 165422-1-165422-11, Year: 2002
25. Tip Influence on Plasmon Excitations in Single Gold Particles in an STM
N. Nilius, N. Ernst, H.-J. Freund
Journal: Phys. Rev. B, Volume: 65, Page: 115421-115428, Year: 2002
24. Structure Sensitivity of CO Dissociation on Rh Surfaces
M. Mavrikakis, M. Bäumer, H.-J. Freund, J. K. Nørskov
Journal: Catal. Lett., Volume: 81, Page: 153-156, Year: 2002
23. Cathodoluminescence of Small Silver Particles on Al2O3/NiAl(110)
W. Drachsel, M. Adelt, N. Nilius, H.-J. Freund
Journal: J. Electr. Spectr. Rel. Phen., Volume: 122, Page: 239-249, Year: 2002
22. Interaction of Oxygen with Palladium Deposited on a Thin Alumina Film
S. Shaikhutdinov, M. Heemeier, J. Hoffmann, I. Meusel, B. Richter, M. Bäumer, H. Kuhlenbeck, J. Libuda, H.-J. Freund, R. Oldman, S. D. Jackson, C. Konvicka, M. Schmid, P. Varga
Journal: Surf. Sci., Volume: 501, Page: 270-281, Year: 2002
21. Preparation of Vanadium and Vanadium Oxide Clusters by Means of Inert Gas Aggregation
M. Melzer, J. Urban, H. Sack-Kongehl, K. Weiss, H.-J. Freund, R. Schlögl
Journal: Catal. Lett., Volume: 81, Page: 219-221, Year: 2002
20. Preparation and Characterization of a Model Bimetallic Catalyst: Co-Pd Nanoparticles Supported on Al2O3
M. Heemeier, A. F. Carlsson, M. Naschitzki, M. Schmal, M. Bäumer, H.-J. Freund
Journal: Angewandte Chemie, International Edition, Volume: 41, Page: 4073-4076, Year: 2002
19. Präparation und Charakterisierung eines bimetallischen Modellkatalysators: Co-Pd-Nanopartikel auf Al2O3
M. Heemeier, A. F. Carlsson, M. Naschitzki, M. Schmal, M. Bäumer, H.-J. Freund
Journal: Angewandte Chemie, Volume: 114, Page: 4242-4245, Year: 2002
18. Rotational Alignment in the Photodesorption of CO from Cr2O3(0001): A Systematic Three-dimensional ab initio Study
S. Thiel, M. Pykavy, T. Klüner, H.-J. Freund, R. Kosloff, V. Staemmler
Journal: J. Chem. Phys., Volume: 116, Page: 762-773, Year: 2002
17. Direct Observation of Radicals in the Activation of Ziegler-Natta Catalysts
T. Risse, J. Schmidt, H. Hamann, H.-J. Freund
Journal: Angew. Chem., Intern. Edition, Volume: 41, Page: 1517-1520, Year: 2002
16. Effect of Carbon Deposits on Reactivity of Supported Pd Model Catalysis
S. Shaikhutdinov, M. Frank, M. Bäumer, S. D. Jackson, R. J. Oldman, J. C. Hemminger, H.-J. Freund
Journal: Catal. Lett., Volume: 80, Page: 115-122, Year: 2002
15. Structure Investigation of the Topmost Layer of a Thin Ordered Alumina Film Grown on NiAl(110) by Low Temperature Scanning Tunneling Microscopy
G. Ceballos, Z. Song, J. J. Pascual, H.-P. Rust, H. Conrad, M. Bäumer, H.-J. Freund
Journal: Chem. Phys. Lett., Volume: 359, Page: 41-47, Year: 2002
14. Rovibrational Preexcitation in the Photodesorption of CO from Cr2O3
S. Thiel, T. Klüner, D. Lemoine, H.-J. Freund
Journal: Chem. Phys., Volume: 282, Page: 361-370, Year: 2002
13. Katalytische Aktivität und Vergiftung spezifischer Plätze auf getragenen Metall-Nanopartikeln
S. Schauermann, J. Hoffmann, V. Johánek, J. Hartmann, J. Libuda, H.-J. Freund
Journal: Angew. Chemie, Volume: 114, Page: 2643-2646, Year: 2002
12. Catalytic Activity and Poisoning of Specific Sites on Supported Metal Nanoparticles
S. Schauermann, J. Hoffmann, V. Johánek, J. Hartmann, J. Libuda, H.-J. Freund
Journal: Angew. Chem. Int. Edition, Volume: 41, Page: 2532-2535, Year: 2002
11. Palladium Deposits on a Single Crystalline Cr2O3(0001) Surface
K. Wolter, H. Kuhlenbeck, H.-J. Freund
Journal: J. Phys. Chem. B, Volume: 106, Page: 6723-6731, Year: 2002
10. CO2 Adsorption on Na Precovered Cr2O3(0001)
O. Seiferth, K. Wolter, H. Kuhlenbeck, H.-J. Freund
Journal: Surf. Sci., Volume: 505, Page: 215-224, Year: 2002
9. Study of CO Adsorption on Crystalline-Silica-Supported Palladium Particles
J. B. Giorgi, Th. Schröder, M. Bäumer, H.-J. Freund
Journal: Surf. Sci. Lett., Volume: 498, Page: L71-L77, Year: 2002
8. Vibrational Sum Frequency on Pd(111) and Supported Pd Nanoparticles: Co Adsorption from Ultrahigh Vacuum to Atmospheric Pressure
H. Unterhalt, G. Rupprechter, H.-J. Freund
Journal: J. Phys. Chem. B, Volume: 106, Page: 356-367, Year: 2002
7. Electron, Photon and Thermally Induced Chemistry in Alkali-NO-coadsorbates on Oxide Surfaces
M. Bender, O. Seiferth, A. F. Carley, A. Chambers, H.-J. Freund. M. W. Roberts
Journal: Surf. Sci., Volume: 513, Page: 221, Year: 2002
6. Reaction Kinetics on Complex Model Catalysts Under Single Scattering Conditions
J. Libuda, H.-J. Freund
Journal: J. Phys. Chem. B, Volume: 106, Page: 4901-4915, Year: 2002
5. Nanofacet-resolved CO Oxidation Kinetics on Alumina-supported Pd Particles
J. Hoffmann, S. Schauermann, J. Hartmann, V. P. Zhdanov, B. Kasemo, J. Libuda, H.-J. Freund
Journal: Chem. Phys. Lett., Volume: 354, Page: 403-408, Year: 2002
4. Clusters and Islands on Oxides: From Catalysis via Electronics and Magnetism to Optics
H.-J. Freund
Journal: Surf. Sci., Volume: 500, Page: 271-299, Year: 2002
3. Oxygen-induced p(2x3) Reconstruction on Mo(112) Studied by LEED and STM
Th. Schröder, J. B. Giorgi, A. Hammoudeh, N. Magg, M. Bäumer, H.-J. Freund
Journal: Phys. Rev. B, Volume: 65, Page: 115411-1 - 8, Year: 2002
2. High-dimensional Quantum Dynamics of Molecules on Surfaces: A Massively Parallel Implementation
St. Borowski, St. Thiel, T. Klüner, H.-J. Freund, R. Tisma, H. Lederer
Journal: Comput. Phys. Commun., Volume: 143, Page: 162-173, Year: 2002
1. Adsorption of Molecular and Atomic Hydrogen on Vacuum-cleaved V2O5(001)
B. Tepper, B. Richter, A.-C. Dupuis, H. Kuhlenbeck, C. Hucho, P. Schilbe, M. A. bin Yarmo, H.-J. Freund
Journal: Surf. Sci., Volume: 496, Page: 64-72, Year: 2002
Impressum • © FHI
Thu, 20. Apr 2017
Address: Fritz-Haber-Institut der Max-Planck-Gesellschaft, Faradayweg 4-6, 14195 Berlin, Germany
Abteilung Chemische Physik - Direktor Prof. Dr. Hajo Freund
Tel: +49 30 8413 4100, Fax: +49 30 8413 4101, E-Mail: freund@fhi-berlin.mpg.de