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6579 results: 6539 articles and 40 books or book chapters

1. 3941 Influence of the van der Waals interaction in the dissociation dynamics of N-2 on W(110) from first principles
   L. Martin-Gondre, J. I. Juaristi, M. Blanco-Rey, R. Diez Muino, and M. Alducin
   J. Chem. Phys. 142, 074704 (2015).
2. 3942 Robust validation of approximate 1-matrix functionals with few-electron harmonium atoms
   J. Cioslowski, M. Piris, and E. Matito
   J. Chem. Phys. 143, 214101 (2015).
3. 3943 Dielectric relaxation of 2-ethyl-1-hexanol around the glass transition by thermally stimulated depolarization currents
   S. Arrese-Igor, A. Alegria, and J. Colmenero
   J. Chem. Phys. 142, 214504 (2015).
4. 3944 Orbitals from local RDMFT: Are they Kohn-Sham or natural orbitals?
   I. Theophilou, N. N. Lathiotakis, N. I. Gidopoulos, A. Rubio, and N. Helbig
   J. Chem. Phys. 143, 054106 (2015).
5. 3945 Diffusion of hydrogen interstitials in the near-surface region of Pd(111) under the influence of surface coverage and external static electric fields
   M. Blanco-Rey, and J. C. Tremblay
   J. Chem. Phys. 142, 154704 (2015).
6. 3946 Bright Fission: Singlet Fission into a Pair of Emitting States
   D. Casanova
   J. Chem. Theory Comput. 11, 2642 (2015).
7. 3947 Quasiparticle Interfacial Level Alignment of Highly Hybridized Frontier Levels: H2O on TiO2(110)
   A. Migani, D. J. Mowbray, J. Zhao, and H. Petek
   J. Chem. Theory Comput. 11, 239 (2015).
8. 3948 Effect of addition of silica- and amine functionalized silica-nanoparticles on the microstructure of calcium silicate hydrate (C-S-H) gel
   M. Monasterio, J. J. Gaitero, E. Erkizia, A. M. Guerrero Bustos, L. A. Miccio, J. S. Dolado, and S. Cerveny
   J. Colloid Interface Sci. 450, 109 (2015).
9. 3949 A Hierarchical Algorithm for Molecular Similarity (H-FORMS)
   A. Ramirez-Manzanares, J. Pena, J. M. Azpiroz, and G. Merino
   J. Comput. Chem. 36, 1456 (2015).
10. 3950 Multiple-time-stepping generalized hybrid Monte Carlo methods
    B. Escribano, E. Akhmatskaya, S. Reich, and J. M. Azpiroz
    J. Comput. Phys. 280, 1 (2015).
11. 3951 Dichroism in the photoionisation of atoms at XUV free-electron lasers
    T. Mazza, E. V. Gryzlova, A. N. Grum-Grzhimailo, A. K. Kazansky, N. M. Kabachnik, and M. Meyer
    J. Electron Spectrosc. Relat. Phenom. 204, 313 (2015).
12. 3952 Aluminum and its effect in the equilibrium between folded/unfolded conformation of NADH
    E. Formoso, J. I. Mujika, S. J. Grabowski, and X. Lopez
    J. Inorg. Biochem. 152, 139 (2015).
13. 3953 Down- and up-conversion emissions in Er3+-Yb3+ codoped TeO2-ZnO-ZnF2 glasses
    A. Miguel, M. A. Arriandiaga, R. Morea, J. Fernandez, J. Gonzalo, and R. Balda
    J. Lumines. 158, 142 (2015).
14. 3954 Synthesis, structure, theoretical studies and luminescent properties of a ternary erbium(III) complex with acetylacetone and bathophenanthroline ligands
    P. Martin-Ramos, P. S. Pereira Silva, P. Chamorro-Posada, M. R. Silva, B. F. Milne, F. Nogueira, and J. Martin-Gil
    J. Lumines. 162, 41 (2015).
15. 3955 Structural, electronic, and magnetic properties of FexCoyNiz (x plus y plus z=13) clusters: A density-functional-theory study
    A. Varas, F. Aguilera-Granja, J. Rogan, and M. Kiwi
    J. Magn. Magn. Mater. 394, 325 (2015).
16. 3956 Heat transport and electron cooling in ballistic normal-metal/spin-filter/superconductor junctions
    S. Kawabata, A. S. Vasenko, A. Ozaeta, S. F. Bergeret, and F. W. J. Hekking
    J. Magn. Magn. Mater. 383, 157 (2015).
17. 3957 Detection of small exchange fields in S/F structures
    A. S. Vasenko, S. Kawabata, A. Ozaeta, A. A. Golubov, V. S. Stolyarov, F. S. Bergeret, and F. W. J. Hekking
    J. Magn. Magn. Mater. 383, 175 (2015).
18. 3958 Interface induced states at the boundary between a 3D topological insulator Bi2Se3 and a ferromagnetic insulator EuS
    S. V. Eremeev, V. N. Men'shov, V. V. Tugushev, and E. V. Chulkov
    J. Magn. Magn. Mater. 383, 30 (2015).
19. 3959 Information-theoretic aspects of friction in the quantum mechanics of an interacting two-electron harmonic atom
    I. Nagy, and M. L. Glasser
    J. Math. Chem. 53, 1274 (2015).
20. 3960 Particle swarm optimization-based continuous cellular automaton for the simulation of deep reactive ion etching
    Y. Li, M. A. Gosalvez, P. Pal, K. Sato, and Y. Xing
    J. Micromech. Microeng. 25, 055023 (2015).