Session Index

Session U21: Focus Session: General Theory: Density Functional Theory and Beyond

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Abstracts
Sponsoring Units: DCOMP
Chair: Eric Shirley, National Institute of Standards and Technology
Room: Colorado Convention Center 106


Thursday, March 8, 2007
8:00AM - 8:36AM

 U21.00001: Berry phase effects on electronic properties
Invited Speaker: Qian Niu

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Thursday, March 8, 2007
8:36AM - 8:48AM

 U21.00002: Local and non-local vertex corrections in GW for extended and localized systems
Martin Stankovski , Andrew Morris , Benjamin Robinson , Rex Godby , Kris Delaney , Patrick Rinke , Ulf von Barth , Carl-Olof Almbladh , Pablo Garc\'Ia-Gonz\'alez

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Thursday, March 8, 2007
8:48AM - 9:00AM

 U21.00003: GW Calculations Starting from Generalized Kohn-Sham Schemes
Frank Fuchs , J{\"u}rgen Furth{\"u}ller , Friedhelm Bechstedt , Maxim Shishkin , Georg Kresse

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Thursday, March 8, 2007
9:00AM - 9:12AM

 U21.00004: The GW space-time formalism at finite temperatures
Matthieu Verstraete , Christoph Freysoldt , Patrick Rinke , Rex Godby

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Thursday, March 8, 2007
9:12AM - 9:24AM

 U21.00005: $GW$ study of f-shell systems
Mark van Schilfgaarde , Athanasios N. Chantis , Takao Kotani , Robert C. Albers

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Thursday, March 8, 2007
9:24AM - 9:36AM

 U21.00006: Exact-exchange based quasiparticle energy calculations applied to (transition) metal nitrides: ScN, InN and more
P. Rinke , M. Scheffler , A. Qteish , J. Neugebauer

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Thursday, March 8, 2007
9:36AM - 9:48AM

 U21.00007: Electron Correlation Effects And The Electronic Structures of Perovskite Ruthenates SrTi1-xRuxO3
Pao-An Lin , T.Y. Chang , Horng-Tay Jeng , Chen-Shiung Hsue

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Thursday, March 8, 2007
9:48AM - 10:00AM

 U21.00008: \textit{Ab initio} calculations of intrinsic and extrinsic losses in x-ray spectra
J. Kas , M. Prange , J. J. Rehr , L. W. Campbell , J. A. Soininen

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Thursday, March 8, 2007
10:00AM - 10:12AM

 U21.00009: Reciprocal space calculations of EELS and XAS spectra without the supercell
Kevin Jorissen , John Rehr

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Thursday, March 8, 2007
10:12AM - 10:24AM

 U21.00010: Real space, real time approach for linear and non-linear optical response of nano-scale molecules
Yoshinari Takimoto , Fernando Vila , John Rehr

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Thursday, March 8, 2007
10:24AM - 10:36AM

 U21.00011: Assigning Spectral Features in Excitonic Spectra
Eric L. Shirley

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Thursday, March 8, 2007
10:36AM - 10:48AM

 U21.00012: A generalized Sham-Schl\"uter equation: the link between nonlocality and frequency dependence
Matteo Gatti , Valerio Olevano , Lucia Reining , Ilya V. Tokatly

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