Search publications

Search results

6574 results: 6534 articles and 40 books or book chapters

1. 4421 Bounds on the PNOF5 natural geminal occupation numbers
   M. Piris
   Comput. Theor. Chem. 1003, 123 (2013).
2. 4422 Second-Row Transition- Metal Doping of (ZniSi), i = 12, 16 Nanoclusters: Structural and Magnetic Properties
   E. Jimenez-Izal, J. M. Matxain, M. Piris, and J. M. Ugalde
   Computation 1, 31 (2013).
3. 4423 Model for the Formation of Helium Bubbles in Palladium
   J. Alfonso Alonso, and A. Ayuela
   Croat. Chem. Acta 86, 425 (2013).
4. 4424 Neel Temperature of Antiferromagnets for Phase Transitions Driven by Spin-wave Interactions
   A. Ayuela, D. J. Klein, and N. H. March
   Croat. Chem. Acta 86, 463 (2013).
5. 4425 Low temperature red luminescence of a fluorinated Mn-doped zinc selenite
   J. Orive, R. Balda, J. Fernandez, L. Lezama, and M. I. Arriortua
   Dalton Trans. 42, 12481 (2013).
6. 4426 One-step wet chemical deposition of NiO from the electrochemical reduction of nitrates in ionic liquid based electrolytes
   E. Azaceta, Ngo Thi Tuyen , D. F. Pickup, C. Rogero, J. Enrique Ortega, O. Miguel, H. -J. Grande, and R. Tena-Zaera
   Electrochim. Acta 96, 261 (2013).
7. 4427 Effects of Localized Trap-States and Corrugation on Charge Transport in Graphene Nanoribbons
   O. Roslyak, U. Aparajita, G. Gumbs, and D. Huang
   Electronics 2, 178 (2013).
8. 4428 Energy-loss straggling of 2-10 MeV/u Kr ions in gases
   C. Vockenhuber, J. Jensen, J. Julin, H. Kettunen, M. Laitinen, M. Rossi, T. Sajavaara, O. Osmani, A. Schinner, P. Sigmund, and H. J. Whitlow
   Eur. Phys. J. D 67, 145 (2013).
9. 4429 Molecules with High Bond Orders and Ultrashort Bond Lengths: CrU, MoU, and WU
   F. Ruiperez, G. Merino, J. M. Ugalde, and I. Infante
   Inorg. Chem. 52, 2838 (2013).
10. 4430 A natural orbital functional based on an explicit approach of the two-electron cumulant
    M. Piris
    Int. J. Quantum Chem. 113, 620 (2013).
11. 4431 Direct Observation of the Formation of Surfactant Micelles under Nonisothermal Conditions by Synchrotron SAXS
    G. V. Jensen, R. Lund, J. Gummel, M. Monkenbusch, T. Narayanan, and J. S. Pedersen
    J. Am. Chem. Soc. 135, 7214 (2013).
12. 4432 On the Effect of a Single Solvent Molecule on the Charge-Transfer Band of a Donor-Acceptor Anion
    J. Houmoller, M. Wanko, K. Stochkel, A. Rubio, and S. B. Nielsen
    J. Am. Chem. Soc. 135, 6818 (2013).
13. 4433 Level Alignment of a Prototypical Photocatalytic System: Methanol on TiO2(110)
    A. Migani, D. J. Mowbray, A. Iacomino, J. Zhao, H. Petek, and A. Rubio
    J. Am. Chem. Soc. 135, 11429 (2013).
14. 4434 Pressure induced phase transitions in TiH2
    G. Gao, A. Bergara, G. Liu, and Y. Ma
    J. Appl. Phys. 113, 103512 (2013).
15. 4435 Structural and electronic properties of Ni26-pXp clusters (X = Pd, Pt): A density-functional-theoretic study
    F. Aguilera-Granja, and L. J. Gallego
    J. Appl. Phys. 114, 054311 (2013).
16. 4436 Modeling the collective relaxation time of glass-forming polymers at intermediate length scales: Application to polyisobutylene
    J. Colmenero, F. Alvarez, Y. Khairy, and A. Arbe
    J. Chem. Phys. 139, 044906 (2013).
17. 4437 Electronic structure of Fe- vs. Ru-based dye molecules
    P. S. Johnson, P. L. Cook, I. Zegkinoglou, J. M. Garcia-Lastra, A. Rubio, R. E. Ruther, R. J. Hamers, and F. J. Himpsel
    J. Chem. Phys. 138, 044709 (2013).
18. 4438 Electronic spectroscopy and electronic structure of diatomic IrSi
    M. A. Garcia, C. Vietz, F. Ruiperez, M. D. Morse, and I. Infante
    J. Chem. Phys. 138, 154306 (2013).
19. 4439 Comment on "Unified explanation of the anomalous dynamic properties ofhighly asymmetric polymer blends'' [J. Chem. Phys. 138, 054903(2013)]
    J. Colmenero
    J. Chem. Phys. 138, 197101 (2013).
20. 4440 Communication: Chemical bonding in carbon dimer isovalent series from the natural orbital functional theory perspective
    J. M. Matxain, F. Ruiperez, I. Infante, X. Lopez, J. M. Ugalde, G. Merino, and M. Piris
    J. Chem. Phys. 138, 151102 (2013).