Bulletin of the American Physical Society

APS March Meeting 2014

Volume 59, Number 1

Monday–Friday, March 3–7, 2014; Denver, Colorado

Session Index

Session G1: Recent Advances in Density Functional Theory III	Show Abstracts
Sponsoring Units: DCP DCOMP Chair: John P. Perdew, Temple University Room: 103/105

Tuesday, March 4, 2014 11:15AM - 11:51AM		G1.00001: Insight into Structural Phase Transitions from Density Functional Theory Invited Speaker: Adrienn Ruzsinszky Preview Abstract
Tuesday, March 4, 2014 11:51AM - 12:03PM		G1.00002: New ways of computing effective potentials for orbital-dependent functionals Viktor N. Staroverov Preview Abstract
Tuesday, March 4, 2014 12:03PM - 12:15PM		G1.00003: Rationalization of Hubbard U in CeOx from first principles: Unveiling the role of local structure in screening Deyu Lu, Ping Liu Preview Abstract
Tuesday, March 4, 2014 12:15PM - 12:27PM		G1.00004: Adiabatic Connection and Virial Theorem for Ensemble Density Functional Theory Aurora Pribram-Jones, Zeng-hui Yang, Carsten Ullrich, Richard Needs, Kieron Burke Preview Abstract
Tuesday, March 4, 2014 12:27PM - 1:03PM		G1.00005: Hybrid Density Functionals Tuned towards Fulfillment of Fundamental DFT Conditions Invited Speaker: Matthias Scheffler Preview Abstract
Tuesday, March 4, 2014 1:03PM - 1:15PM		G1.00006: Performance of optimally-tuned range-separated hybrid functionals in predicting molecular valence-electron spectra David A. Egger, Shira Weissman, Sivan Refaely-Abramson, Sahar Sharifzadeh, Matthias Dauth, Roi Baer, Stephan Kuemmel, Jeffrey B. Neaton, Egbert Zojer, Leeor Kronik Preview Abstract
Tuesday, March 4, 2014 1:15PM - 1:27PM		G1.00007: Electronic structure of CuPc from an optimally-tuned range-separated hybrid functional Shira Weissman, Sivan Refaely-Abramson, David A. Egger, Egbert Zojer, Leeor Kronik Preview Abstract
Tuesday, March 4, 2014 1:27PM - 1:39PM		G1.00008: Kinetic and Hole Contributions to the Exact TDDFT Correlation Potential Kai Luo, Johanna Fuks, Ernesto Sandoval, Peter Elliott, Neepa Maitra Preview Abstract
Tuesday, March 4, 2014 1:39PM - 1:51PM		G1.00009: First-Principles Studies of the Excited States and Optical Properties of Xanthene Derivative Chromophores Samia Hamed, Sahar Sharifzadeh, Jeffrey Neaton Preview Abstract
Tuesday, March 4, 2014 1:51PM - 2:03PM		G1.00010: Exact Factorization of the Electron-Nuclear Wavefunction: Exact Electronic Potentials in Coupled Electron-Ion Dynamics Yasumitsu Suzuki, Ali Abedi, Neepa T. Maitra, Koichi Yamashita, E.K.U. Gross Preview Abstract
Tuesday, March 4, 2014 2:03PM - 2:15PM		G1.00011: ABSTRACT WITHDRAWN Preview Abstract

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Bulletin of the American Physical Society

APS March Meeting 2014

Volume 59, Number 1

Monday–Friday, March 3–7, 2014; Denver, Colorado

Session Index

Session G1: Recent Advances in Density Functional Theory III

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