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7302 results: 7242 articles and 60 books or book chapters

1. 6561 Beyond time-dependent exact exchange: The need for long-range correlation
   F. Bruneval, F. Sottile, V. Olevano, and L. Reining
   J. Chem. Phys. 124, 144113 (2006).
2. 6562 Non-Gaussian energy landscape of a simple model for strong network-forming liquids: Accurate evaluation of the configurational entropy
   A. J. Moreno, I. Saika-Voivod, E. Zaccarelli, E. La Nave, S. V. Buldyrev, P. Tartaglia, and F. Sciortino
   J. Chem. Phys. 124, 204509 (2006).
3. 6563 Photoabsorption spectra of Ti8C12 metallocarbohedrynes: Theoretical spectroscopy within time-dependent density functional theory
   J. I. Martinez, A. Castro, A. Rubio, and J. A. Alonso
   J. Chem. Phys. 125, 074311 (2006).
4. 6564 Electronic structure and excitations in oligoacenes from ab initio calculations
   E. S. Kadantsev, M. J. Stott, and A. Rubio
   J. Chem. Phys. 124, 134901 (2006).
5. 6565 Electronic structure of C-60 on Au(887)
   F. Schiller, M. Ruiz-Oses, J. E. Ortega, P. Segovia, J. Martinez-Blanco, B. P. Doyle, V. Perez-Dieste, J. Lobo, N. Neel, R. Berndt, and J. Kroeger
   J. Chem. Phys. 125, 144719 (2006).
6. 6566 Optical absorption spectra of V-4(+) isomers: One example of first-principles theoretical spectroscopy with time-dependent density functional theory
   J. I. Martinez, A. Castro, A. Rubio, and J. A. Alonso
   J. Comput. Theor. Nanosci. 3, 761 (2006).
7. 6567 A study of the coordination shell of aluminum(III) and magnesium(II) in model protein of the complex formation and environments: Thermodynamics metal exchange reactions
   E. Rezabal, J. M. Mercero, X. Lopez, and J. M. Ugalde
   J. Inorg. Biochem. 100, 374 (2006).
8. 6568 Molecular motions in glassy polycarbonate below its glass transition temperature
   S. Arrese-Igor, O. Mitxelena, A. Arbe, A. Alegria, J. Colmenero, and B. Frick
   J. Non-Cryst. Solids 352, 5072 (2006).
9. 6569 Site selective spectroscopy of Eu3+ in heavy-metal oxide glasses
   C. Cascales, R. Balda, J. Fernandez, M. A. Arriandiaga, and J. M. Fdez-Navarro
   J. Non-Cryst. Solids 352, 2448 (2006).
10. 6570 Spectroscopic properties of Yb3+ ions in halogeno-sulfide glasses
    R. Balda, V. Seznec, V. Nazabal, J. -L. Adam, M. Al-Saleh, and J. Fernandez
    J. Non-Cryst. Solids 352, 2444 (2006).
11. 6571 Investigation of local chain dynamics in poly(di-n-alkylitaconate)s
    A. -C. Genix, and F. Laupretre
    J. Non-Cryst. Solids 352, 5035 (2006).
12. 6572 Hydrogen dynamics in polyethersulfone: A quasielastic neutron scattering study in the high-momentum transfer region
    I. Quintana, A. Arbe, J. Colmenero, and B. Frick
    J. Non-Cryst. Solids 352, 4610 (2006).
13. 6573 Surface magnetic behavior and microstructures of ferromagnetic(Co77Si13.5B9.5)(90)Fe7Nb3 ribbons
    L. Fernandez, A. Chizhik, N. Iturriza, J. J. Del Val, and J. Gonzalez
    J. Optoelectron. Adv. Mater. 8, 1698 (2006).
14. 6574 Soft magnetic behaviour of nanocrystalline Fe-based glass-coated microwires
    C. Garcia, A. Zhukov, M. Ipatov, V. Zhukova, J. J. Del Val, L. Dominguez, J. M. Blanco, V. Larin, and J. Gonzalez
    J. Optoelectron. Adv. Mater. 8, 1667 (2006).
15. 6575 Dirac density matrix and the Legendre transform of the kinetic energy generated by one-dimensional model potentials
    I. A. Howard, and N. H. March
    J. Phys. A-Math. Gen. 39, 565 (2006).
16. 6576 Water adsorption and diffusion on NaCl(100)
    P. Cabrera-Sanfelix, A. Arnau, G. R. Darling, and D. Sanchez-Portal
    J. Phys. Chem. B 110, 24559 (2006).
17. 6577 Self-assembly of heterogeneous supramolecular structures with uniaxial anisotropy
    M. Ruiz-Oses, N. Gonzalez-Lakunza, I. Silanes, A. Gourdon, A. Arnau, and J. E. Ortega
    J. Phys. Chem. B 110, 25573 (2006).
18. 6578 Reaction mechanism of the acidic hydrolysis of highly twisted amides: Rate acceleration caused by the twist of the amide bond
    J. I. Mujika, E. Formoso, J. M. Mercero, and X. Lopez
    J. Phys. Chem. B 110, 15000 (2006).
19. 6579 A TDDFT study of the excited states of DNA bases and their assemblies
    D. Varsano, R. Di Felice, M. A. L. Marques, and A. Rubio
    J. Phys. Chem. B 110, 7129 (2006).
20. 6580 Pressure induced metallization of Germane
    M. Martinez-Canales, A. Bergara, J. Feng, and W. Grochala
    J. Phys. Chem. Solids 67, 2095 (2006).