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6817 results: 6779 articles and 38 books or book chapters

Last updated: 2025/10/20
  1. Scientific article 5141 Time-dependent density-functional and reduced density-matrix methods for few electrons: Exact versus adiabatic approximations
    N. Helbig, J. I. Fuks, I. V. Tokatly, H. Appel, E. K. U. Gross, and A. Rubio
    Chem. Phys. 391, 1 (2011).
  2. Scientific article 5142 Assessment of dressed time-dependent density-functional theory for the low-lying valence states of 28 organic chromophores
    M. Huix-Rotllant, A. Ipatov, A. Rubio, and M. E. Casida
    Chem. Phys. 391, 120 (2011).
  3. Scientific article 5143 Rotational dynamics of propylene in ZSM-5 zeolitic frameworks
    S. Gautam, V. K. Sharma, S. Mitra, S. L. Chaplot, and R. Mukhopadhyay
    Chem. Phys. Lett. 501, 345 (2011).
  4. Scientific article 5144 What Is the Covalency of Hydrogen Bonding?
    S. Janusz Grabowski
    Chem. Rev. 111, 2597 (2011).
  5. Scientific article 5145 On the Nature of Actinide- and Lanthanide-Metal Bonds in Heterobimetallic Compounds
    B. Vlaisavljevich, P. Miro, C. J. Cramer, L. Gagliardi, I. Infante, and S. T. Liddle
    Chem.-Eur. J. 17, 8424 (2011).
  6. Scientific article 5146 Broadband Dielectric Spectroscopic, Calorimetric, and FTIR-ATR Investigations of D-Arabinose Aqueous Solutions
    L. P. Singh, S. Cerveny, A. Alegria, and J. Colmenero
    ChemPhysChem 12, 3624 (2011).
  7. Scientific article 5147 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).
  8. Scientific article 5148 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).
  9. Scientific article 5149 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).
  10. Scientific article 5150 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).
  11. Scientific article 5151 Electron Delocalization in Organic Chemistry
    E. Matito, and Prof Sola
    Curr. Org. Chem. 15, 3554 (2011).
  12. Scientific article 5152 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).
  13. Scientific article 5153 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).
  14. Scientific article 5154 Anharmonicity in aluminum hydride at high pressures
    B. Rousseau, and A. Bergara
    High Pressure Res. 31, 30 (2011).
  15. Scientific article 5155 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).
  16. Scientific article 5156 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).
  17. Scientific article 5157 A COMPOSITE FERMION APPROACH TO THE ULTRACOLD DILUTE FERMI GAS
    M. A. Cazalilla
    Int. J. Mod. Phys. B 25, 329 (2011).
  18. Scientific article 5158 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).
  19. Scientific article 5159 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).
  20. Scientific article 5160 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).
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