Theoretical Spectroscopy Group

L. Reining, “Insight and prediction of materials properties from ab initio calculations of electronic excitations”. OSI-VIII Optic of surfaces and interfaces VIII, 2009.

H. - C. Weissker, Hambach, R., Olevano, V., and Reining, L., “Interpolation between spectra satisfying sum rules”, Physical Review B, vol. 79. APS, p. 094102, 2009.

W. Wełnic, Wuttig, M., Botti, S., and Reining, L., “Local atomic order and optical properties in amorphous and laser-crystallized GeTe”, C.R. Physique, vol. 10. pp. 514-527, 2009.

L. Reining, “Many−Body Perturbation Theory: approaches and applications, limitations and good news”. KITP workshop From Basic Concepts to Real Materials, Santa Barbara (USA), 2009.

H. Hübener and Brandes, T., “Master equations for quantum transport with Franck-Condon blockade”, Phys. Rev. B, vol. 80. American Physical Society, p. 155437, 2009.

S. Botti, Castro, A., Lathiotakis, N. N., Andrade, X., and Marques, M., “Optical and magnetic properties of boron fullerenes”, Phys. Chem. Chem. Phys, vol. 11, Page 4523. 2009.

F. Sottile, “Plane-waves approach to Energy Loss Spectroscopy: Features, tools and results”. Understanding Materials through Electron Microscopes: Realising the Potential, Imperial College of London, United Kingdom, 2009.

M. Holzmann, Bernu, B., Olevano, V., Martin, R. M., and Ceperley, D. M., “Renormalization factor and effective mass of the two-dimensional electron gas”, Phys. Rev. B, 2009.

P. Romaniello, Guyot, S., and Reining, L., “The self-energy beyond GW: Local and nonlocal vertex corrections”, The Journal of Chemical Physics, vol. 131. AIP, p. 154111, 2009.

R. Hambach, Giorgetti, C., Sottile, F., and Reining, L., “Spatial Resolution in Electron Energy-Loss Spectroscopy”. DPG Spring Meeting, Dresden (Germany), 2009.

L. Reining, “Theoretical spectroscopy”, Comptes rendus physique, vol. Tome 10 N°6. 2009.

F. Sottile, “Time Dependent Density Functional Theory: Introduction and Applications”. International Workshop on Current Topics in Transmission Electron Microscopy: Plasmonics and Strain Mapping, Ringberg Castle, Munich, Germany, 2009.

E. Papalazarou, Gatti, M., Marsi, M., Brouet, V., Iori, F., Reining, L., Annese, E., Vobornik, I., Offi, F., Fondacaro, A., Huotari, S., Lacovig, P., Tjernberg, O., Brookes, N. B., Sacchi, M., Metcalf, P., and Panaccione, G., “Valence-band electronic structure of V[sub 2]O[sub 3]: Identification of V and O bands”, Physical Review B (Condensed Matter and Materials Physics), vol. 80. APS, p. 155115, 2009.

F. Sottile, “Ab Initio calculations of electronic excitations: Carbon Nanotubes and Graphene layer systems”. 11th Journées de la Matière Condensée, Strasbourg, France, 2008.

L. Reining, “Ab initio calculations of electronic response - ingredients, results and challenges”. Workshop Recent Developments in Electronic Structure, University of Illinois Urbana (USA), 2008.

P. E. Trevisanutto, Giorgetti, C., Reining, L., Ladisa, M., and Olevano, V., “Ab Initio GW Many-Body Effects in Graphene”, Physical Review Letters, vol. 101. APS, p. 226405, 2008.

V. V. Ivanovskaya, Zobelli, A., Gloter, A., Brun, N., Serin, V., and Colliex, C., “Ab initio study of bilateral doping within the $MoS_{2}-NbS_{2}$ system”, Phys. Rev. B, vol. 78. American Physical Society, p. 134104, 2008.

A. - G. Marinopoulos, Reining, L., and Rubio, A., “Ab initio study of the dielectric response of crystalline ropes of metallic single-walled carbon nanotubes: Tube-diameter and helicity effects”, Phys. Rev. B, vol. 78. American Physical Society, p. 235428, 2008.

E. Luppi, Weissker, H. - C., Bottaro, S., Sottile, F., Veniard, V., Reining, L., and Onida, G., “Accuracy of the pseudopotential approximation in ab initio theoretical spectroscopies”, Physical Review B, vol. 78. p. 245124, 2008.

R. Hambach, Giorgetti, C., Hiraoka, N., Cai, Y. Q., Sottile, F., Marinopoulos, A. - G., Bechstedt, F., and Reining, L., “Anomalous Angular Dependence of the Dynamic Structure Factor near Bragg Reflections: Graphite”, Physical Review Letters, vol. 101. APS, p. 266406, 2008.

S. Botti, Castro, A., Andrade, X., Rubio, A., and Marques, M., “Cluster-surface and cluster-cluster interactions: Ab initio calculations and modeling of asymptotic van der Waals forces”, PHYSICAL REVIEW B, vol. 78, 035333. AMER PHYSICAL SOC, ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA, 2008.

R. Hambach, “EELS for Graphite, Graphene and SWCNTs: Plasmons and LFE.”. MORE2008 Vienna (Austria), 2008.

L. Reining, “Electronic response: theoretical approaches and link to experiment”. MORE: Meeting on Optical Response in Extended Systems, Vienna (Austria), 2008.

L. Reining, “Exchange and correlation effects in electronic spectra: contributions from ab initio calculations”. Workshop on X-ray spectroscopies: theory and experiment, Lausanne (Switzerland), 2008.

S. Ossicini, Bisi, O., Degoli, E., Marri, I., Iori, F., Luppi, E., Magri, R., Poli, R., Cantele, G., Ninno, D., Trani, F., Marsili, M., Pulci, O., Olevano, V., Gatti, M., Gaal-Nagy, K., Incze, A., and Onida, G., “First-principles study of silicon nanocrystals: Structural and electronic properties, absorption, emission, and doping”, JOURNAL OF NANOSCIENCE AND NANOTECHNOLOGY, vol. 8. pp. 479-492, 2008.