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7330 results: 7270 articles and 60 books or book chapters
Last updated: 2026/08/24-
5421
Electronic and magnetic properties of NiS2, NiSSe and NiSe2 by a
combination of theoretical methods
C. Schuster, M. Gatti, and A. Rubio
Eur. Phys. J. B 85, 325 (2012). -
5422
Study of tetrabutylammonium bromide in aqueous solution by neutron
scattering
D. Bhowmik, N. Malikova, J. Teixeira, G. Meriguet, O. Bernard, P. Turq, and W. Haeussler
Eur. Phys. J.-Spec. Top. 213, 303 (2012). -
5423
Hot Carrier Solar Cells: Controlling Thermalization in Ultrathin Devices
A. Le Bris, J. Rodiere, C. Colin, S. Collin, J. -L. Pelouard, R. Esteban, M. Laroche, J. -J. Greffet, and J. -F. Guillemoles
IEEE J. Photovolt. 2, 506 (2012). -
5424
Molecular Conductance in Relation to Inverse Transport Theory and to
Chemical Bond Order
D. J. Klein, and N. H. March
Int. J. Quantum Chem. 112, 99 (2012). -
5425
Inertness and degradation of (0001) surface of Bi2Se3 topological
insulator
V. A. Golyashov, K. A. Kokh, S. V. Makarenko, K. N. Romanyuk, I. P. Prosvirin, A. V. Kalinkin, O. E. Tereshchenko, A. S. Kozhukhov, D. V. Sheglov, S. V. Eremeev, S. D. Borisova, and E. V. Chulkov
J. Appl. Phys. 112, 113702 (2012). -
5426
Isotope effect in the superconducting high-pressure simple cubic phase
of calcium from first principles
I. Errea, B. Rousseau, and A. Bergara
J. Appl. Phys. 111, 112604 (2012). -
5427
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). -
5428
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). -
5429
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). -
5430
Cluster glasses of ultrasoft particles
D. Coslovich, M. Bernabei, and A. J. Moreno
J. Chem. Phys. 137, 184904 (2012). -
5431
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). -
5432
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). -
5433
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). -
5434
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). -
5435
Electron-pair density decomposition for core-valence separable systems
J. Wang, Y. Wang, and J. M. Ugalde
J. Comput. Chem. 33, 2243 (2012). -
5436
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). -
5437
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). -
5438
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). -
5439
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). -
5440
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).