O 64: Focussed session: Theory and computation of electronic structure: new frontiers V (jointly with HL, DS)
Thursday, March 17, 2011, 11:15–13:00, TRE Phy
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11:15 |
O 64.1 |
Topical Talk:
Electronic excitations in thin-film materials for solar cells: beyond standard density functional theory — •Silvana Botti
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11:45 |
O 64.2 |
What is the G0W0 band gap of ZnO? — Martin Stankovski, •Gabriel Antonius, David Waroquiers, Anna Miglio, Hemant Dixit, Patrick Rinke, Hong Jiang, Matteo Giantomassi, Xavier Gonze, Michel Côté, and Gian-Marco Rignanese
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12:00 |
O 64.3 |
Global exploration of the energy landscape of solids on the ab initio level — •Klaus Doll, Aniket Kulkarni, Dejan Zagorac, J. Christian Schön, and Martin Jansen
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12:15 |
O 64.4 |
Ab initio calculations of electronic excitations: Collapsing spectral sums — •Arjan Berger, Lucia Reining, and Francesco Sottile
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12:30 |
O 64.5 |
Oxides – a challenge for (theoretical) spectroscopy — •Patrick Rinke, Hong Jiang, Matthias Scheffler, Andreas Greuling, Michael Rohlfing, Anderson Janotti, Emmanouil Kioupakis, and Chris G. Van de Walle
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12:45 |
O 64.6 |
The surprising accuracy of semilocal functionals within density functional theory (DFT): A study of systems involving point defects — •Rampi Ramprasad, Patrick Rinke, and Matthias Scheffler
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