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7378 results: 7318 articles and 60 books or book chapters

1. 5721 An O(N-3) implementation of Hedin's GW approximation for molecules
   D. Foerster, P. Koval, and D. Sanchez-Portal
   J. Chem. Phys. 135, 074105 (2011).
2. 5722 Analog of Rabi oscillations in resonant electron-ion systems
   L. Stella, R. P. Miranda, A. P. Horsfield, and A. J. Fisher
   J. Chem. Phys. 134, 194105 (2011).
3. 5723 From caging to Rouse dynamics in polymer melts with intramolecular barriers: A critical test of the mode coupling theory
   M. Bernabei, A. J. Moreno, E. Zaccarelli, F. Sciortino, and J. Colmenero
   J. Chem. Phys. 134, 024523 (2011).
4. 5724 Effect of hydration on the dielectric properties of C-S-H gel
   S. Cerveny, S. Arrese-Igor, J. S. Dolado, J. J. Gaitero, A. Alegria, and J. Colmenero
   J. Chem. Phys. 134, 034509 (2011).
5. 5725 Free volume holes diffusion to describe physical aging in poly(mehtyl methacrylate)/silica nanocomposites
   D. Cangialosi, V. M. Boucher, A. Alegria, and J. Colmenero
   J. Chem. Phys. 135, 014901 (2011).
6. 5726 A multiconfigurational time-dependent Hartree-Fock method for excited electronic states. I. General formalism and application to open-shell states
   R. P. Miranda, A. J. Fisher, L. Stella, and A. P. Horsfield
   J. Chem. Phys. 134, 244101 (2011).
7. 5727 A multiconfigurational time-dependent Hartree-Fock method for excited electronic states. II. Coulomb interaction effects in single conjugated polymer chains
   R. P. Miranda, A. J. Fisher, L. Stella, and A. P. Horsfield
   J. Chem. Phys. 134, 244102 (2011).
8. 5728 Positron annihilation and relaxation dynamics from dielectric spectroscopy and nuclear magnetic resonance: Cis-trans-1,4-poly(butadiene)
   J. Bartos, O. Sausa, G. A. Schwartz, A. Alegria, J. M. Alberdi, A. Arbe, J. Kristiak, and J. Colmenero
   J. Chem. Phys. 134, 164507 (2011).
9. 5729 Design of effective kernels for spectroscopy and molecular transport: Time-dependent current-density-functional theory
   M. Gatti
   J. Chem. Phys. 134, 084102 (2011).
10. 5730 Study of the structure and dynamics of poly(vinyl pyrrolidone) by molecular dynamics simulations validated by quasielastic neutron scattering and x-ray diffraction experiments
    R. Busselez, A. Arbe, F. Alvarez, J. Colmenero, and B. Frick
    J. Chem. Phys. 134, 054904 (2011).
11. 5731 Fractional spin in reduced density-matrix functional theory
    N. Helbig, G. Theodorakopoulos, and N. N. Lathiotakis
    J. Chem. Phys. 135, 054109 (2011).
12. 5732 A natural orbital functional for multiconfigurational states
    M. Piris, X. Lopez, F. Ruiperez, J. M. Matxain, and J. M. Ugalde
    J. Chem. Phys. 134, 164102 (2011).
13. 5733 Structure, electronic, and optical properties of TiO2 atomic clusters: An ab initio study
    L. Chiodo, M. Salazar, A. H. Romero, S. Laricchia, F. Della Sala, and A. Rubio
    J. Chem. Phys. 135, 244704 (2011).
14. 5734 Determining concentration depth profiles in fluorinated networks by means of electric force microscopy
    L. A. Miccio, M. M. Kummali, P. E. Montemartini, P. A. Oyanguren, G. A. Schwartz, A. Alegria, and J. Colmenero
    J. Chem. Phys. 135, 064704 (2011).
15. 5735 Unoccupied states in Cu and Zn octaethyl-porphyrin and phthalocyanine
    P. L. Cook, W. Yang, X. Liu, J. Maria Garcia-Lastra, A. Rubio, and F. J. Himpsel
    J. Chem. Phys. 134, 204707 (2011).
16. 5736 Quasielastic neutron scattering study of hydrogen motions in an aqueous poly(vinyl methyl ether) solution
    S. Capponi, A. Arbe, S. Cerveny, R. Busselez, B. Frick, J. P. Embs, and J. Colmenero
    J. Chem. Phys. 134, 204906 (2011).
17. 5737 The free volume of poly(vinyl methylether) as computed in a wide temperature range and at length scales up to the nanoregion
    D. Racko, S. Capponi, F. Alvarez, and J. Colmenero
    J. Chem. Phys. 134, 044512 (2011).
18. 5738 Quantum chemical assessment of the binding energy of CuO+
    E. Rezabal, J. Gauss, J. M. Matxain, R. Berger, M. Diefenbach, and M. C. Holthausen
    J. Chem. Phys. 134, 064304 (2011).
19. 5739 Kinetic energy distribution of multiply charged ions in Coulomb explosion of Xe clusters
    A. Heidenreich, and J. Jortner
    J. Chem. Phys. 134, 074315 (2011).
20. 5740 Complete vs Restricted Active Space Perturbation Theory Calculation of the Cr-2 Potential Energy Surface
    F. Ruiperez, F. Aquilante, J. M. Ugalde, and I. Infante
    J. Chem. Theory Comput. 7, 1640 (2011).