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7344 results: 7284 articles and 60 books or book chapters

1. 5441 Non-adiabatic effects within a single thermally averaged potential energy surface: Thermal expansion and reaction rates of small molecules
   J. L. Alonso, A. Castro, J. Clemente-Gallardo, P. Echenique, J. J. Mazo, V. Polo, A. Rubio, and D. Zueco
   J. Chem. Phys. 137, 22A533 (2012).
2. 5442 Vibrational deexcitation and rotational excitation of H-2 and D-2 scattered from Cu(111): Adiabatic versus non-adiabatic dynamics
   A. S. Muzas, J. I. Juaristi, M. Alducin, R. Diez Muino, G. J. Kroes, and C. Diaz
   J. Chem. Phys. 137, 064707 (2012).
3. 5443 Component dynamics in polyvinylpyrrolidone concentrated aqueous solutions
   R. Busselez, A. Arbe, S. Cerveny, S. Capponi, J. Colmenero, and B. Frick
   J. Chem. Phys. 137, 084902 (2012).
4. 5444 Cluster glasses of ultrasoft particles
   D. Coslovich, M. Bernabei, and A. J. Moreno
   J. Chem. Phys. 137, 184904 (2012).
5. 5445 The extended Koopmans' theorem: Vertical ionization potentials from natural orbital functional theory
   M. Piris, J. M. Matxain, X. Lopez, and J. M. Ugalde
   J. Chem. Phys. 136, 174116 (2012).
6. 5446 Dynamical reaction pathways in Eley-Rideal recombination of nitrogen from W(100)
   E. Quintas-Sanchez, P. Larregaray, C. Crespos, L. Martin-Gondre, J. Rubayo-Soneira, and J. -C. Rayez
   J. Chem. Phys. 137, 064709 (2012).
7. 5447 Performance of PNOF5 Natural Orbital Functional for Radical Formation Reactions: Hydrogen Atom Abstraction and C-C and O-O Homolytic Bond Cleavage in Selected Molecules
   X. Lopez, F. Ruiperez, M. Piris, J. M. Matxain, E. Matito, and J. M. Ugalde
   J. Chem. Theory Comput. 8, 2646 (2012).
8. 5448 Molecular diversity, metabolic transformation, and evolution of carotenoid feather pigments in cotingas (Aves: Cotingidae)
   R. O. Prum, A. M. LaFountain, J. Berro, M. C. Stoddard, and H. A. Frank
   J. Comp. Physiol. B-Biochem. Syst. Environ. Physiol. 182, 1095 (2012).
9. 5449 Electron-pair density decomposition for core-valence separable systems
   J. Wang, Y. Wang, and J. M. Ugalde
   J. Comput. Chem. 33, 2243 (2012).
10. 5450 Lifetimes of electronic excitations in unoccupied surface states and the image potential states on Pd(110)
    S. S. Tsirkin, S. V. Eremeev, and E. V. Chulkov
    J. Exp. Theor. Phys. 115, 673 (2012).
11. 5451 Pro-oxidant activity of aluminum: Promoting the Fenton reaction by reducing Fe(III) to Fe(II)
    F. Ruiperez, J. J. Mujika, J. M. Ugalde, C. Exley, and X. Lopez
    J. Inorg. Biochem. 117, 118 (2012).
12. 5452 Spectroscopy of thulium and holmium heavily doped tellurite glasses
    H. Gebavi, D. Milanese, R. Balda, S. Taccheo, J. Fernandez, J. Lousteau, and M. Ferraris
    J. Lumines. 132, 270 (2012).
13. 5453 Semiconductor nanowires self-assembled from colloidal CdTe nanocrystal building blocks: optical properties and application perspectives
    Y. P. Rakovich, F. Jaeckel, J. F. Donegan, and A. L. Rogach
    J. Mater. Chem. 22, 20831 (2012).
14. 5454 A first-principles study of II-VI (II = Zn; VI = O, S, Se, Te) semiconductor nanostructures
    J. M. Azpiroz, I. Infante, X. Lopez, J. M. Ugalde, and F. De Angelis
    J. Mater. Chem. 22, 21453 (2012).
15. 5455 Hybrid organic/inorganic semiconductor nanostructures with highly efficient energy transfer
    D. Savateeva, D. Melnikau, V. Lesnyak, N. Gaponik, and Y. P. Rakovich
    J. Mater. Chem. 22, 10816 (2012).
16. 5456 Moments of powers of the Hulthen density
    M. L. Glasser, and I. Nagy
    J. Math. Chem. 50, 1707 (2012).
17. 5457 The Storage of Hydrogen in Nanoporous Carbons
    J. A. Alonso, I. Cabria, and M. J. Lopez
    J. Mex. Chem. Soc. 56, 261 (2012).
18. 5458 Etched profile control in anisotropic etching of silicon by TMAH plus Triton
    P. Pal, M. A. Gosalvez, and K. Sato
    J. Micromech. Microeng. 22, 065013 (2012).
19. 5459 Evolutionary determination of kinetic Monte Carlo rates for the simulation of evolving surfaces in anisotropic etching of silicon
    Y. Xing, M. A. Gosalvez, K. Sato, M. Tian, and H. Yi
    J. Micromech. Microeng. 22, 085020 (2012).
20. 5460 Evolutionary continuous cellular automaton for the simulation of wet etching of quartz
    N. Ferrando, M. A. Gosalvez, and R. J. Colom
    J. Micromech. Microeng. 22, 025021 (2012).