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7033 results: 6990 articles and 43 books or book chapters
Last updated: 2026/03/11-
5241
A computational study on the intriguing mechanisms of the gas-phase
thermal activation of methane by bare [Ni(H)(OH)](+)
O. Lakuntza, J. M. Matxain, F. Ruiperez, M. Besora, F. Maseras, J. M. Ugalde, M. Schlangen, and H. Schwarz
Phys. Chem. Chem. Phys. 14, 9306 (2012). -
5242
CBe5E- (E = Al, Ga, In, Tl): planar pentacoordinate carbon in
heptaatomic clusters
A. C. Castro, G. Martinez-Guajardo, T. Johnson, J. M. Ugalde, Y. -bo Wu, J. M. Mercero, T. Heine, K. J. Donald, and G. Merino
Phys. Chem. Chem. Phys. 14, 14764 (2012). -
5243
Dissociative and non-dissociative adsorption dynamics of N-2 on Fe(110)
I. Goikoetxea, M. Alducin, R. Diez Muino, and J. I. Juaristi
Phys. Chem. Chem. Phys. 14, 7471 (2012). -
5244
An interpretation of the absorption and emission spectra of the gold
dimer using modern theoretical tools
K. R. Geethalakshmi, F. Ruiperez, S. Knecht, J. M. Ugalde, M. D. Morse, and I. Infante
Phys. Chem. Chem. Phys. 14, 8732 (2012). -
5245
Aluminum speciation in biological environments. The deprotonation of
free and aluminum bound citrate in aqueous solution
J. I. Mujika, J. M. Ugalde, and X. Lopez
Phys. Chem. Chem. Phys. 14, 12465 (2012). -
5246
Substitution effects on the absorption spectra of nitrophenolate isomers
M. Wanko, J. Houmoller, K. Stochkel, M. -B. S. Kirketerp, M. A. Petersen, M. B. Nielsen, S. B. Nielsen, and A. Rubio
Phys. Chem. Chem. Phys. 14, 12905 (2012). -
5247
Orientation-dependent retarding force of a three-dimensional degenerate
electron gas for slow homonuclear trimers
O. Osmani, and I. Nagy
Phys. Rev. A 86, 042901 (2012). -
5248
Tuning the Kosterlitz-Thouless transition to zero temperature in
anisotropic boson systems
J. -S. You, H. Lee, S. Fang, M. A. Cazalilla, and D. -W. Wang
Phys. Rev. A 86, 043612 (2012). -
5249
Band-structure effects in photoelectron-emission spectra from metal
surfaces
C. A. Rios Rubiano, M. S. Gravielle, D. M. Mitnik, and V. M. Silkin
Phys. Rev. A 85, 043422 (2012). -
5250
Exact time evolution of the pair distribution function for an entangled
two-electron initial state
I. Nagy, I. Aldazabal, and A. Rubio
Phys. Rev. A 86, 022512 (2012). -
5251
Effect of partial temporal coherence of XUV pulses in IR-laser-assisted
photoionization
A. K. Kazansky, I. P. Sazhina, and N. M. Kabachnik
Phys. Rev. A 86, 033404 (2012). -
5252
Series expansions for an exact two-electron wave function in terms of
Lowdin's renormalized natural orbitals
I. Nagy, and I. Aldazabal
Phys. Rev. A 85, 034501 (2012). -
5253
Dichroism in short-pulse two-color XUV plus IR multiphoton ionization of
atoms
A. K. Kazansky, A. V. Grigorieva, and N. M. Kabachnik
Phys. Rev. A 85, 053409 (2012). -
5254
Optical properties of calcium under pressure from first-principles
calculations
I. Errea, B. Rousseau, A. Eiguren, and A. Bergara
Phys. Rev. B 86, 085106 (2012). -
5255
Quantum-well states with image state character for Pb overlayers on
Cu(111)
A. Zugarramurdi, N. Zabala, V. M. Silkin, E. V. Chulkov, and A. G. Borisov
Phys. Rev. B 86, 075434 (2012). -
5256
Inversed linear dichroism in F K-edge NEXAFS spectra of fluorinated
planar aromatic molecules
D. G. de Oteyza, A. Sakko, A. El-Sayed, E. Goiri, L. Floreano, A. Cossaro, J. M. Garcia-Lastra, A. Rubio, and J. E. Ortega
Phys. Rev. B 86, 075469 (2012). -
5257
Challenges in truncating the hierarchy of time-dependent reduced density
matrices equations
A. Akbari, M. J. Hashemi, A. Rubio, R. M. Nieminen, and R. van Leeuwen
Phys. Rev. B 85, 235121 (2012). -
5258
LiB and its boron-deficient variants under pressure
A. Hermann, A. Suarez-Alcubilla, I. G. Gurtubay, L. -M. Yang, A. Bergara, N. W. Ashcroft, and R. Hoffmann
Phys. Rev. B 86, 144110 (2012). -
5259
Temperature dependence of the dynamics of the first image-potential
state on Ag(111)
S. S. Tsirkin, S. V. Eremeev, E. V. Chulkov, M. Marks, K. Schubert, J. Guedde, and U. Hoefer
Phys. Rev. B 86, 085424 (2012). -
5260
Orbital polaron in double-exchange ferromagnets
T. L. van den Berg, P. Lombardo, R. O. Kuzian, and R. Hayn
Phys. Rev. B 86, 235114 (2012).