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7406 results: 7346 articles and 60 books or book chapters

Last updated: Oct 26, 2026
  1. Scientific article 5981 U and P-4 Reaction Products: A Quantum Chemical and Matrix Isolation Spectroscopic Investigation
    B. Vlaisavljevich, L. Gagliardi, X. Wang, B. Liang, L. Andrews, and I. Infante
    Inorg. Chem. 49, 9230 (2010).
  2. Scientific article 5982 AB INITIO APPROACH TO STRUCTURAL, ELECTRONIC AND OPTICAL PROPERTIES OF B-, C- AND N-DOPED ANATASE
    V. P. Zhukov, V. M. Zainullina, and E. V. Chulkov
    Int. J. Mod. Phys. B 24, 6049 (2010).
  3. Scientific article 5983 The magnetic moments and their long-range ordering for Fe atoms in a wide variety of metallic environments
    A. Ayuela, and N. H. March
    Int. J. Quantum Chem. 110, 2725 (2010).
  4. Scientific article 5984 Energy bands, conductance, and thermoelectric power for ballistic electrons in a nanowire with spin-orbit interaction
    G. Gumbs, A. Balassis, and D. Huang
    J. Appl. Phys. 108, 093704 (2010).
  5. Scientific article 5985 Communication: The role of the positivity N-representability conditions in natural orbital functional theory
    M. Piris, J. M. Matxain, X. Lopez, and J. M. Ugalde
    J. Chem. Phys. 133, 111101 (2010).
  6. Scientific article 5986 Copper-phthalocyanine based metal-organic interfaces: The effect of fluorination, the substrate, and its symmetry
    D. G. de Oteyza, A. El-Sayed, J. M. Garcia-Lastra, E. Goiri, T. N. Krauss, A. Turak, E. Barrena, H. Dosch, J. Zegenhagen, A. Rubio, Y. Wakayama, and J. E. Ortega
    J. Chem. Phys. 133, 214703 (2010).
  7. Scientific article 5987 Optical to ultraviolet spectra of sandwiches of benzene and transition metal atoms: Time dependent density functional theory and many-body calculations
    J. I. Martinez, J. M. Garcia-Lastra, M. J. Lopez, and J. A. Alonso
    J. Chem. Phys. 132, 044314 (2010).
  8. Scientific article 5988 Chain dynamics of poly(ethylene-alt-propylene) melts by means of coarse-grained simulations based on atomistic molecular dynamics
    R. Perez-Aparicio, J. Colmenero, F. Alvarez, J. T. Padding, and W. J. Briels
    J. Chem. Phys. 132, 024904 (2010).
  9. Scientific article 5989 Time-dependent density functional approach for the calculation of inelastic x-ray scattering spectra of molecules
    A. Sakko, A. Rubio, M. Hakala, and K. Hamalainen
    J. Chem. Phys. 133, 174111 (2010).
  10. Scientific article 5990 Basis set effects on the hyperpolarizability of CHCl3: Gaussian-type orbitals, numerical basis sets and real-space grids
    F. D. Vila, D. A. Strubbe, Y. Takimoto, X. Andrade, A. Rubio, S. G. Louie, and J. J. Rehr
    J. Chem. Phys. 133, 034111 (2010).
  11. Scientific article 5991 Quantum Monte Carlo study of the ground state and low-lying excitedstates of the scandium dimer (vol 128, 194315, 2008)
    J. M. Matxain, E. Rezabal, X. Lopez, J. M. Ugalde, and L. Gagliardi
    J. Chem. Phys. 132, 139901 (2010).
  12. Scientific article 5992 Communications: Accurate description of atoms and molecules by natural orbital functional theory
    M. Piris, J. M. Matxain, X. Lopez, and J. M. Ugalde
    J. Chem. Phys. 132, 031103 (2010).
  13. Scientific article 5993 Size consistency of explicit functionals of the natural orbitals in reduced density matrix functional theory
    N. N. Lathiotakis, N. I. Gidopoulos, and N. Helbig
    J. Chem. Phys. 132, 084105 (2010).
  14. Scientific article 5994 Communication: Systematic shifts of the lowest unoccupied molecular orbital peak in x-ray absorption for a series of 3d metal porphyrins
    J. M. Garcia-Lastra, P. L. Cook, F. J. Himpsel, and A. Rubio
    J. Chem. Phys. 133, 151103 (2010).
  15. Scientific article 5995 Attenuation of excited electrons at crystal surfaces
    I. Bartos, and E. E. Krasovskii
    J. Electron Spectrosc. Relat. Phenom. 180, 66 (2010).
  16. Scientific article 5996 On different mechanisms of electron-phonon scattering of electron and hole excitations on an Ag(110) surface
    S. V. Eremeev, S. S. Tsirkin, and E. V. Chulkov
    J. Exp. Theor. Phys. 110, 788 (2010).
  17. Scientific article 5997 Change in surface states of Ag(111) thin films upon adsorption of a monolayer of PTCDA organic molecules
    N. L. Zaitsev, I. A. Nechaev, and E. V. Chulkov
    J. Exp. Theor. Phys. 110, 114 (2010).
  18. Scientific article 5998 Magnetic force microscopy characterization of heat and current treated Fe40Ni38Mo4B18 amorphous ribbons
    I. Garcia, N. Iturriza, J. Jose del Val, H. Grande, J. A. Pomposo, and J. Gonzalez
    J. Magn. Magn. Mater. 322, 1822 (2010).
  19. Scientific article 5999 Positron annihilation response and broadband dielectric spectroscopy: Poly(propylene glycol)
    J. Bartos, G. A. Schwartz, O. Sausa, A. Alegria, J. Kristiak, and J. Colmenero
    J. Non-Cryst. Solids 356, 782 (2010).
  20. Scientific article 6000 Dielectric relaxation of various end-functionalized polystyrenes: Plastification effects versus specific dynamics
    R. Lund, S. Plaza-Garcia, A. Alegria, J. Colmenero, J. Janoski, S. R. Chowdhury, and R. P. Quirk
    J. Non-Cryst. Solids 356, 676 (2010).
Publications on this list, in general, only include scientific articles indexed in the main collection of the Web of Science (WoS), excluding abstracts and conference proceedings.