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6326 results: 6286 articles and 40 books or book chapters

1. 5101 Atomic motions in poly(vinyl methyl ether): A combined study by quasielastic neutron scattering and molecular dynamics simulations in the light of the mode coupling theory
   S. Capponi, A. Arbe, F. Alvarez, J. Colmenero, B. Frick, and J. P. Embs
   J. Chem. Phys. 131, 204901 (2009).
2. 5102 Exact Kohn-Sham potential of strongly correlated finite systems
   N. Helbig, I. V. Tokatly, and A. Rubio
   J. Chem. Phys. 131, 224105 (2009).
3. 5103 Influence of a dielectric layer on photon emission induced by a scanning tunneling microscope
   X. Tao, Z. C. Dong, J. L. Yang, Y. Luo, J. G. Hou, and J. Aizpurua
   J. Chem. Phys. 130, 084706 (2009).
4. 5104 Ab initio electronic and optical spectra of free-base porphyrins: The role of electronic correlation
   M. Palummo, C. Hogan, F. Sottile, P. Bagala, and A. Rubio
   J. Chem. Phys. 131, 084102 (2009).
5. 5105 Dielectric relaxations in ribose and deoxyribose supercooled water solutions
   S. E. Pagnotta, S. Cerveny, A. Alegria, and J. Colmenero
   J. Chem. Phys. 131, 085102 (2009).
6. 5106 Spin conserving natural orbital functional theory
   M. Piris, J. M. Matxain, X. Lopez, and J. M. Ugalde
   J. Chem. Phys. 131, 021102 (2009).
7. 5107 High pressure dynamics of polymer/plasticizer mixtures
   G. Ariel Schwartz, M. Paluch, A. Alegria, and J. Colmenero
   J. Chem. Phys. 131, 044906 (2009).
8. 5108 Study of the dynamics of poly(ethylene oxide) by combining molecular dynamic simulations and neutron scattering experiments
   M. Brodeck, F. Alvarez, A. Arbe, F. Juranyi, T. Unruh, O. Holderer, J. Colmenero, and D. Richter
   J. Chem. Phys. 130, 094908 (2009).
9. 5109 Calculations of trapping and desorption in heavy atom collisions with surfaces
   G. Fan, and J. R. Manson
   J. Chem. Phys. 130, 064703 (2009).
10. 5110 On the temperature dependence of the nonexponentiality in glass-forming liquids
    D. Cangialosi, A. Alegria, and J. Colmenero
    J. Chem. Phys. 130, 124902 (2009).
11. 5111 Neutron scattering study of the dynamics of a polymer melt under nanoscopic confinement
    M. Krutyeva, J. Martin, A. Arbe, J. Colmenero, C. Mijangos, G. J. Schneider, T. Unruh, Y. Su, and D. Richter
    J. Chem. Phys. 131, 174901 (2009).
12. 5112 The free-volume structure of a polymer melt, poly(vinyl methylether) from molecular dynamics simulations and cavity analysis
    D. Racko, S. Capponi, F. Alvarez, J. Colmenero, and J. Bartos
    J. Chem. Phys. 131, 064903 (2009).
13. 5113 The electronic structure of oxygen atom vacancy and hydroxyl impurity defects on titanium dioxide (110) surface
    T. Minato, Y. Sainoo, Y. Kim, H. S. Kato, K. -ichi Aika, M. Kawai, J. Zhao, H. Petek, T. Huang, W. He, B. Wang, Z. Wang, Y. Zhao, J. Yang, and J. G. Hou
    J. Chem. Phys. 130, 124502 (2009).
14. 5114 The Many-Body Exchange-Correlation Hole at Metal Surfaces
    L. A. Constantin, and J. M. Pitarke
    J. Chem. Theory Comput. 5, 895 (2009).
15. 5115 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).
16. 5116 Iterative Diagonalization for Orbital Optimization in Natural Orbital Functional Theory
    M. Piris, and J. M. Ugalde
    J. Comput. Chem. 30, 2078 (2009).
17. 5117 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).
18. 5118 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).
19. 5119 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).
20. 5120 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).