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6931 results: 6893 articles and 38 books or book chapters

1. 5721 Modified Ehrenfest Formalism for Efficient Large-Scale ab initio Molecular Dynamics
   X. Andrade, A. Castro, D. Zueco, J. L. Alonso, P. Echenique, F. Falceto, and A. Rubio
   J. Chem. Theory Comput. 5, 728 (2009).
2. 5722 Iterative Diagonalization for Orbital Optimization in Natural Orbital Functional Theory
   M. Piris, and J. M. Ugalde
   J. Comput. Chem. 30, 2078 (2009).
3. 5723 Near infrared to visible upconversion of Er3+ in CaZrO3/CaSZ eutectic crystals with ordered lamellar microstructure
   R. Balda, S. Garcia-Revilla, J. Fernandez, R. I. Merino, J. I. Pena, and V. M. Orera
   J. Lumines. 129, 1422 (2009).
4. 5724 Study of the induced potential produced by ultrashort pulses on metal surfaces
   M. Faraggi, I. Aldazabal, M. Silvia Gravielle, A. Arnau, and V. M. Silkin
   J. Opt. Soc. Am. B-Opt. Phys. 26, 2331 (2009).
5. 5725 Time-dependent theory of Auger decay induced by ultra-short pulses in a strong laser field
   A. K. Kazansky, I. P. Sazhina, and N. M. Kabachnik
   J. Phys. B-At. Mol. Opt. Phys. 42, 245601 (2009).
6. 5726 Sideband structure in angle-resolved electron spectra from laser-assisted Auger decay generated by ultra-short pulses
   A. K. Kazansky, and N. M. Kabachnik
   J. Phys. B-At. Mol. Opt. Phys. 42, 121002 (2009).
7. 5727 Adsorption and Reactivity of CO2 on Defective Graphene Sheets
   P. Cabrera-Sanfelix
   J. Phys. Chem. A 113, 493 (2009).
8. 5728 Aluminum Incorporation to Dreierketten Silicate Chains
   H. Manzano, J. S. Dolado, and A. Ayuela
   J. Phys. Chem. B 113, 2832 (2009).
9. 5729 Modeling Protein Splicing: Reaction Pathway for C-Terminal Splice and Intein Scission
   J. I. Mujika, X. Lopez, and A. J. Mulholland
   J. Phys. Chem. B 113, 5607 (2009).
10. 5730 Fingerprints of Bonding Motifs in DNA Duplexes of Adenine and Thymine Revealed from Circular Dichroism: Synchrotron Radiation Experiments and TDDFT Calculations
    L. M. Nielsen, A. I. S. Holm, D. Varsano, U. Kadhane, S. V. Hoffmann, R. Di Felice, A. Rubio, and S. B. Nielsen
    J. Phys. Chem. B 113, 9614 (2009).
11. 5731 Evidence of High center dot OH Radical Quenching Efficiency by Vitamin B-6
    J. M. Matxain, D. Padro, M. Ristila, A. Strid, and L. A. Eriksson
    J. Phys. Chem. B 113, 9629 (2009).
12. 5732 A Dynamic Landscape from Femtoseconds to Minutes for Excess Electrons at Ice-Metal Interfaces
    U. Bovensiepen, C. Gahl, J. Staehler, M. Bockstedte, M. Meyer, F. Baletto, S. Scandolo, X. -Y. Zhu, A. Rubio, and M. Wolf
    J. Phys. Chem. C 113, 979 (2009).
13. 5733 Experimental Relation between Stranski-Krastanov Growth of DIP/F16CoPC Heterostructures and the Reconstruction of the Organic Interface
    D. G. de Oteyza, E. Barrena, Y. Zhang, T. N. Krauss, A. Turak, A. Vorobiev, and H. Dosch
    J. Phys. Chem. C 113, 4234 (2009).
14. 5734 Dissipative effects in the dynamics of N-2 on tungsten surfaces
    I. Goikoetxea, J. I. Juaristi, M. Alducin, and R. Diez Muino
    J. Phys.-Condes. Matter 21, 264007 (2009).
15. 5735 Electronic states in faceted Au(111) studied with curved crystal surfaces
    M. Corso, F. Schiller, L. Fernandez, J. Cordon, and J. E. Ortega
    J. Phys.-Condes. Matter 21, 353001 (2009).
16. 5736 Coupling of conduction electrons to two-level systems formed by hydrogen: a scattering approach
    I. Nagy, and A. Zawadowski
    J. Phys.-Condes. Matter 21, 175701 (2009).
17. 5737 Very-low-energy electron diffraction from TiS2: experiment and ab initio theory
    E. E. Krasovskii, and V. N. Strocov
    J. Phys.-Condes. Matter 21, 314009 (2009).
18. 5738 Electromagnetic field enhancement in TERS configurations
    Z. Yang, J. Aizpurua, and H. Xu
    J. Raman Spectrosc. 40, 1343 (2009).
19. 5739 Ordered structures of pentacene on Cu(110)
    J. Martinez-Blanco, M. Ruiz-Oses, V. Joco, D. I. Sayago, P. Segovia, and E. G. Michel
    J. Vac. Sci. Technol. B 27, 863 (2009).
20. 5740 Synthesis of Cationic Polyelectrolytes by Inverse Microemulsion Polymerization
    G. Gonzalez, J. M. Ugalde, J. C. de la Cal, and J. M. Asua
    Macromol. Rapid Commun. 30, 2036 (2009).