Search publications

Search results

7161 results: 7118 articles and 43 books or book chapters

1. 4241 Low-Lying pi pi* States of Heteroaromatic Molecules: A Challenge for Excited State Methods
   A. Prlj, M. Eugenia Sandoval-Salinas, D. Casanova, D. Jacquemin, and C. Corminboeuf
   J. Chem. Theory Comput. 12, 2652 (2016).
2. 4242 Interplay Between Aromaticity and Strain in Double Group Transfer Reactions to 1,2-Benzyne
   I. Fernandez, and F. P. Cossio
   J. Comput. Chem. 37, 1265 (2016).
3. 4243 The Barrier to the Methyl Rotation in Cis-2-Butene and its Isomerization Energy to Trans-2-Butene, Revisited
   C. F. Matta, S. Sadjadi, D. A. Braden, and G. Frenking
   J. Comput. Chem. 37, 143 (2016).
4. 4244 Polarization-selective enhancement of Nd3+ photoluminescence assisted by linear chains of silver nanoparticles
   E. Yraola, L. Sanchez-Garcia, C. Tserkezis, P. Molina, M. O. Ramirez, J. Aizpurua, and L. E. Bausa
   J. Lumines. 169, 569 (2016).
5. 4245 Er3+-doped fluorotellurite thin film glasses with improved photoluminescence emission at 1.53 mu m
   R. Morea, A. Miguel, T. T. Fernandez, B. Mate, F. J. Ferrer, C. Maffiotte, J. Fernandez, R. Balda, and J. Gonzalo
   J. Lumines. 170, 778 (2016).
6. 4246 Coherence characteristics of random lasing in a dye doped hybrid powder
   S. Garcia-Revilla, J. Fernandez, M. Barredo-Zuriarrain, E. Pecoraro, M. A. Arriandiaga, I. Iparraguirre, J. Azkargorta, and R. Balda
   J. Lumines. 169, 472 (2016).
7. 4247 Transient mechanochromism in epoxy vitrimer composites containing aromatic disulfide crosslinks
   A. Ruiz de Luzuriaga, J. M. Matxain, F. Ruiperez, R. Martin, J. M. Asua, G. Cabanero, and I. Odriozola
   J. Mater. Chem. C 4, 6220 (2016).
8. 4248 Fluctuations During Anisotropic Etching: Local Recalibration and Application to Si110
   M. A. Gosalvez, Y. Li, N. Ferrando, P. Pal, K. Sato, and Y. Xing
   J. Microelectromech. Syst. 25, 788 (2016).
9. 4249 Evidence for faster etching at the mask-substrate interface: atomistic simulation of complex cavities at the micron-/submicron-scale by the continuous cellular automaton
   M. A. Gosalvez, N. Ferrando, Y. Fedoryshyn, J. Leuthold, and K. M. McPeak
   J. Micromech. Microeng. 26, 045013 (2016).
10. 4250 Angular distribution and circular dichroism in the two-colour XUV plus NIR above-threshold ionization of helium
    T. Mazza, M. Ilchen, A. J. Rafipoor, C. Callegari, P. Finetti, O. Plekan, K. C. Prince, R. Richter, A. Demidovich, C. Grazioli, L. Avaldi, P. Bolognesi, M. Coreno, P. O'Keeffe, M. Di Fraia, M. Devetta, Y. Ovcharenko, V. Lyamayev, S. Duesterer, K. Ueda, et al.
    J. Mod. Opt. 63, 367 (2016).
11. 4251 Structural, electronic, and magnetic properties of Fe (x) Co (y) Pd (z) (x plus y plus z aecurrency sign 7) clusters: a density functional theory study
    A. Varas, F. Aguilera-Granja, J. Rogan, and M. Kiwi
    J. Nanopart. Res. 18, 252 (2016).
12. 4252 Hybrid cluster-expansion and density-functional-theory approach for optical absorption in TiO2
    O. Vaenskae, M. P. Ljungberg, P. Springer, D. Sanchez-Portal, M. Kira, and S. W. Koch
    J. Opt. Soc. Am. B-Opt. Phys. 33, C123 (2016).
13. 4253 Stereospecific Synthesis of alpha-Amino Allylsilane Derivatives through a [3,3]-Allyl Cyanate Rearrangement. Mild Formation of Functionalized Disiloxanes
    S. Henrion, B. Carboni, , F. P. Cossio, T. Roisnel, J. M. Villalgordo, and F. Carreaux
    J. Org. Chem. 81, 4633 (2016).
14. 4254 Angle resolved photoelectron spectroscopy of two-color XUV-NIR ionization with polarization control
    S. Duesterer, G. Hartmann, F. Babies, A. Beckmann, G. Brenner, J. Buck, J. Costello, L. Dammann, A. De Fanis, P. Gessler, L. Glaser, M. Ilchen, P. Johnsson, A. K. Kazansky, T. J. Kelly, T. Mazza, M. Meyer, V. L. Nosik, I. P. Sazhina, F. Scholz, et al.
    J. Phys. B-At. Mol. Opt. Phys. 49, 165003 (2016).
15. 4255 4th International Conference on Chemical Bonding
    J. M. Ugalde, P. Bultinck, F. M. Bickelhaupt, and A. N. Alexandrova
    J. Phys. Chem. A 120, 9353 (2016).
16. 4256 Disentangling Vacancy Oxidation on Metallicity-Sorted Carbon Nanotubes
    D. J. Mowbray, A. Perez Paz, G. Ruiz-Soria, M. Sauer, P. Lacovig, M. Dalmiglio, S. Lizzit, K. Yanagi, A. Goldoni, T. Pichler, P. Ayala, and A. Rubio
    J. Phys. Chem. C 120, 18316 (2016).
17. 4257 Metallic and Magnetic 2D Materials Containing Planar Tetracoordinated C and N
    E. Jimenez-Izal, M. Saeys, and A. N. Alexandrova
    J. Phys. Chem. C 120, 21685 (2016).
18. 4258 Molecular-Level Realignment in Donor-Acceptor Bilayer Blends on Metals
    P. Borghetti, D. G. de Oteyza, C. Rogero, E. Goiri, A. Verdini, A. Cossaro, L. Floreano, and J. E. Ortega
    J. Phys. Chem. C 120, 5997 (2016).
19. 4259 Intra- and Intermolecular Singlet Fission in Covalently Linked Dimers
    X. Feng, D. Casanova, and A. I. Krylov
    J. Phys. Chem. C 120, 19070 (2016).
20. 4260 Search for a Metallic Dangling-Bond Wire on n-Doped H-Passivated Semiconductor Surfaces
    M. Engelund, N. Papior, P. Brandimarte, T. Frederiksen, A. Garcia-Lekue, and D. Sanchez-Portal
    J. Phys. Chem. C 120, 20303 (2016).