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7391 results: 7331 articles and 60 books or book chapters

1. 5721 Diradicals and Diradicaloids in Natural Orbital Functional Theory
   X. Lopez, F. Ruiperez, M. Piris, J. M. Matxain, and J. M. Ugalde
   ChemPhysChem 12, 1061 (2011).
2. 5722 Natural Orbital Functional Theory and Reactivity Studies of Diradical Rearrangements: Ethylene Torsion as a Case Study
   X. Lopez, M. Piris, J. M. Matxain, F. Ruiperez, and J. M. Ugalde
   ChemPhysChem 12, 1673 (2011).
3. 5723 Octree-based, GPU implementation of a continuous cellular automaton for the simulation of complex, evolving surfaces
   N. Ferrando, M. A. Gosalvez, J. Cerda, R. Gadea, and K. Sato
   Comput. Phys. Commun. 182, 628 (2011).
4. 5724 Surface assembly of porphyrin nanorods with one-dimensional zinc-oxygen spinal cords
   M. Trelka, C. Urban, C. Rogero, P. de Mendoza, E. Mateo-Marti, Y. Wang, I. Silanes, D. Ecija, M. Alcami, F. Yndurain, A. Arnau, F. Martin, A. M. Echavarren, J. Angel Martin-Gago, J. Maria Gallego, R. Otero, and R. Miranda
   Crystengcomm 13, 5591 (2011).
5. 5725 Electron Delocalization in Organic Chemistry
   E. Matito, and Prof Sola
   Curr. Org. Chem. 15, 3554 (2011).
6. 5726 Matrix Infrared Spectroscopy and a Theoretical Investigation of SUO and US2
   L. Andrews, X. Wang, B. Liang, F. Ruiperez, I. Infante, A. D. Raw, and J. A. Ibers
   Eur. J. Inorg. Chem. , 4457 (2011).
7. 5727 Exotic high pressure behavior of light alkali metals, lithium and sodium
   B. Rousseau, Y. Xie, Y. Ma, and A. Bergara
   Eur. Phys. J. B 81, 1 (2011).
8. 5728 Anharmonicity in aluminum hydride at high pressures
   B. Rousseau, and A. Bergara
   High Pressure Res. 31, 30 (2011).
9. 5729 Electronic Structure and Bonding in Heteronuclear Dimers of V, Cr, Mo, and W: a CASSCF/CASPT2 Study
   F. Ruiperez, J. M. Ugalde, and I. Infante
   Inorg. Chem. 50, 9219 (2011).
10. 5730 Enhancement of the Luminescent Properties of a New Red-Emitting Phosphor, Mn-2(HPO3)F-2, by Zn Substitution
    J. Orive, J. L. Mesa, R. Balda, J. Fernandez, J. Rodriguez Fernandez, T. Rojo, and M. I. Arriortua
    Inorg. Chem. 50, 12463 (2011).
11. 5731 A COMPOSITE FERMION APPROACH TO THE ULTRACOLD DILUTE FERMI GAS
    M. A. Cazalilla
    Int. J. Mod. Phys. B 25, 329 (2011).
12. 5732 Model for a Biexciton in a Lateral Quantum Dot Based on Exact Solutions for the Hookean H-2 Molecule. I. Theoretical Aspects
    E. V. Ludena, L. Echevarria, J. M. Ugalde, X. Lopez, and A. Corella-Madueno
    Int. J. Quantum Chem. 111, 1808 (2011).
13. 5733 A half-step in quantized conductance for low-density electrons in a quantum wire
    G. Gumbs, A. Balassis, D. Huang, S. Ahmed, and R. Brennan
    J. Appl. Phys. 110, 073709 (2011).
14. 5734 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).
15. 5735 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).
16. 5736 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).
17. 5737 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).
18. 5738 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).
19. 5739 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).
20. 5740 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).