Dr. Kristian Sommer Thygesen - Publications

Years

These papers are ordered by article relevance.

Renormalization of Molecular Quasiparticle Levels at Metal-Molecule Interfaces: Trends across Binding Regimes
K.S. Thygesen, A. Rubio
Physical Review Letters 102, 46802 (2009)
Localized atomic basis set in the projector augmented wave method
Ask Hjorth Larsen, Marco Vanin, Jens Jørgen Mortensen, Kristian Sommer Thygesen, Karsten Wedel Jacobsen
Physical Review B 80, 195112 (2009)
Polarization-induced renormalization of molecular levels at metallic and semiconducting surfaces
J.M. García-Lastra, C. Rostgaard, A. Rubio, K. S. Thygesen
Physical Review B 80, 245427 (2009)
Hot electron assisted femtochemistry at surfaces - A time-dependent density functional theory approach
J. Gavholt, A. Rubio, T. Olsen, K. Thygesen, J. Schiotz
Physical Review B 79, 195405 - 10 (2009)
Influence of O2 and N2 on the conductivity of carbon nanotube networks
D. J. Mowbray, C. Morgan, K. S. Thygesen
Physical Review B 79, 195431 (2009)
Stability and Electronic Properties of TiO2 Nanostructures With and Without B and N Doping
D.J. Mowbray, J.I. Martínez, J.M. García-Lastra, K.S. Thygesen, K.W. Jacobsen
Journal Of Physical Chemistry C 113, 12301 - 12308 (2009)
Density functional theory based screening of ternary alkali-transition metal borohydrides: A computational material design project
J. S. Hummelshøj, D. D. Landis, J. Voss, T. Jiang, A. Tekin, N. Bork, M. Dulak, J. J. Mortensen, L. Adamska, J. Andersin, J. D. Baran, G. D. Barmparis, F. Bell, A. L. Bezanilla, J. Bjork, M. E. Björketun, F. Bleken, F. Buchter, M. Bürkle, P. D. Burton, B. B. Buus, A. Calborean, F. Calle-Vallejo, S. Casolo, B. D. Chandler, D. H. Chi, I Czekaj, S. Datta, A. Datye, A. DeLaRiva, V Despoja, S. Dobrin, M. Engelund, L. Ferrighi, P. Frondelius, Q. Fu, A. Fuentes, J. Fürst, A. García-Fuente, J. Gavnholt, R. Goeke, S. Gudmundsdottir, K. D. Hammond, H. A. Hansen, D. Hibbitts, E. Hobi, Jr., J. G. Howalt, S. L. Hruby, A. Huth, L. Isaeva, J. Jelic, I. J. T. Jensen, K. A. Kacprzak, A. Kelkkanen, D. Kelsey, D. S. Kesanakurthi, J. Kleis, P. J. Klüpfel, I Konstantinov, R. Korytar, P. Koskinen, C. Krishna, E. Kunkes, A. H. Larsen, J. M. García Lastra, H. Lin, O. Lopez-Acevedo, M. Mantega, J. I. Martínez, I. N. Mesa, D. J. Mowbray, J. S. G. Mýrdal, Y. Natanzon, A. Nistor, T. Olsen, H. Park, L. S. Pedroza, V Petzold, C. Plaisance, J. A. Rasmussen, H. Ren, M. Rizzi, A. S. Ronco, C. Rostgaard, S. Saadi, L. A. Salguero, E. J. G. Santos, A. L. Schoenhalz, J. Shen, M. Smedemand, O. J. Stausholm-Møller, M. Stibius, M. Strange, H. B. Su, B. Temel, A. Toftelund, V Tripkovic, M. Vanin, V Viswanathan, A. Vojvodic, S. Wang, J. Wellendorff, K. S. Thygesen, J. Rossmeisl, T. Bligaard, K. W. Jacobsen, J. K. Nørskov, T. Vegge
Journal of Chemical Physics 131, 014101 (2009)
Correlated electron transport in molecular junctions
K.S. Thygesen, A. Rubio
Oxford Handbook of Nanoscience and Technology: Frontiers and Advances, Ed. A.V. Narlikar and Y.Y. Fu, Oxford University Pressp. 865 - 910 (2009)