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7294 results: 7234 articles and 60 books or book chapters
Last updated: 2026/08/03-
6081
The free-volume structure of a polymer melt, poly(vinyl methylether)
from molecular dynamics simulations and cavity analysis
D. Racko, S. Capponi, F. Alvarez, J. Colmenero, and J. Bartos
J. Chem. Phys. 131, 064903 (2009). -
6082
The electronic structure of oxygen atom vacancy and hydroxyl impurity
defects on titanium dioxide (110) surface
T. Minato, Y. Sainoo, Y. Kim, H. S. Kato, K. -ichi Aika, M. Kawai, J. Zhao, H. Petek, T. Huang, W. He, B. Wang, Z. Wang, Y. Zhao, J. Yang, and J. G. Hou
J. Chem. Phys. 130, 124502 (2009). -
6083
The Many-Body Exchange-Correlation Hole at Metal Surfaces
L. A. Constantin, and J. M. Pitarke
J. Chem. Theory Comput. 5, 895 (2009). -
6084
Modified Ehrenfest Formalism for Efficient Large-Scale ab initio
Molecular Dynamics
X. Andrade, A. Castro, D. Zueco, J. L. Alonso, P. Echenique, F. Falceto, and A. Rubio
J. Chem. Theory Comput. 5, 728 (2009). -
6085
Iterative Diagonalization for Orbital Optimization in Natural Orbital
Functional Theory
M. Piris, and J. M. Ugalde
J. Comput. Chem. 30, 2078 (2009). -
6086
Near infrared to visible upconversion of Er3+ in CaZrO3/CaSZ eutectic
crystals with ordered lamellar microstructure
R. Balda, S. Garcia-Revilla, J. Fernandez, R. I. Merino, J. I. Pena, and V. M. Orera
J. Lumines. 129, 1422 (2009). -
6087
Study of the induced potential produced by ultrashort pulses on metal
surfaces
M. Faraggi, I. Aldazabal, M. Silvia Gravielle, A. Arnau, and V. M. Silkin
J. Opt. Soc. Am. B-Opt. Phys. 26, 2331 (2009). -
6088
Time-dependent theory of Auger decay induced by ultra-short pulses in a
strong laser field
A. K. Kazansky, I. P. Sazhina, and N. M. Kabachnik
J. Phys. B-At. Mol. Opt. Phys. 42, 245601 (2009). -
6089
Sideband structure in angle-resolved electron spectra from
laser-assisted Auger decay generated by ultra-short pulses
A. K. Kazansky, and N. M. Kabachnik
J. Phys. B-At. Mol. Opt. Phys. 42, 121002 (2009). -
6090
Adsorption and Reactivity of CO2 on Defective Graphene Sheets
P. Cabrera-Sanfelix
J. Phys. Chem. A 113, 493 (2009). -
6091
Aluminum Incorporation to Dreierketten Silicate Chains
H. Manzano, J. S. Dolado, and A. Ayuela
J. Phys. Chem. B 113, 2832 (2009). -
6092
Modeling Protein Splicing: Reaction Pathway for C-Terminal Splice and
Intein Scission
J. I. Mujika, X. Lopez, and A. J. Mulholland
J. Phys. Chem. B 113, 5607 (2009). -
6093
Fingerprints of Bonding Motifs in DNA Duplexes of Adenine and Thymine
Revealed from Circular Dichroism: Synchrotron Radiation Experiments and
TDDFT Calculations
L. M. Nielsen, A. I. S. Holm, D. Varsano, U. Kadhane, S. V. Hoffmann, R. Di Felice, A. Rubio, and S. B. Nielsen
J. Phys. Chem. B 113, 9614 (2009). -
6094
Evidence of High center dot OH Radical Quenching Efficiency by Vitamin
B-6
J. M. Matxain, D. Padro, M. Ristila, A. Strid, and L. A. Eriksson
J. Phys. Chem. B 113, 9629 (2009). -
6095
A Dynamic Landscape from Femtoseconds to Minutes for Excess Electrons at
Ice-Metal Interfaces
U. Bovensiepen, C. Gahl, J. Staehler, M. Bockstedte, M. Meyer, F. Baletto, S. Scandolo, X. -Y. Zhu, A. Rubio, and M. Wolf
J. Phys. Chem. C 113, 979 (2009). -
6096
Experimental Relation between Stranski-Krastanov Growth of DIP/F16CoPC
Heterostructures and the Reconstruction of the Organic Interface
D. G. de Oteyza, E. Barrena, Y. Zhang, T. N. Krauss, A. Turak, A. Vorobiev, and H. Dosch
J. Phys. Chem. C 113, 4234 (2009). -
6097
Dissipative effects in the dynamics of N-2 on tungsten surfaces
I. Goikoetxea, J. I. Juaristi, M. Alducin, and R. Diez Muino
J. Phys.-Condes. Matter 21, 264007 (2009). -
6098
Electronic states in faceted Au(111) studied with curved crystal
surfaces
M. Corso, F. Schiller, L. Fernandez, J. Cordon, and J. E. Ortega
J. Phys.-Condes. Matter 21, 353001 (2009). -
6099
Coupling of conduction electrons to two-level systems formed by
hydrogen: a scattering approach
I. Nagy, and A. Zawadowski
J. Phys.-Condes. Matter 21, 175701 (2009). -
6100
Very-low-energy electron diffraction from TiS2: experiment and ab initio
theory
E. E. Krasovskii, and V. N. Strocov
J. Phys.-Condes. Matter 21, 314009 (2009).