Session Index

Session P19: Focus Session: Frontiers in Electronic Structure Theory IV

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Abstracts
Sponsoring Units: DCP DCOMP
Chair: Troy van Voonhis, Massachusetts Institute of Technology
Room: Colorado Convention Center 104


Wednesday, March 7, 2007
11:15AM - 11:51AM

P19.00001: Ab-initio DMRG and Canonical Transformation Theories of Electronic Structure
Invited Speaker: Garnet Chan

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Wednesday, March 7, 2007
11:51AM - 12:27PM

P19.00002: Real-time {\it ab initio} simulations of excited-state dynamics in nanostructures
Invited Speaker: David Tomanek

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Wednesday, March 7, 2007
12:27PM - 12:39PM

P19.00003: First principles spectroscopy of confined water.
Manu Sharma , Giulia Galli

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Wednesday, March 7, 2007
12:39PM - 12:51PM

P19.00004: Quadratic Scaling Local Canonical Transformation Method.
Debashree Ghosh , Takeshi Yanai , Garnet Kin-Lic Chan

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Wednesday, March 7, 2007
12:51PM - 1:03PM

P19.00005: Representing molecules as atomic-scale electrical circuits with fluctuating-charge models
Jiahao Chen , Todd Mart\'Inez

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Wednesday, March 7, 2007
1:03PM - 1:15PM

P19.00006: Partition-of-unity finite element method for large, accurate electronic-structure calculations
John Pask , Natarajan Sukumar

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Wednesday, March 7, 2007
1:15PM - 1:27PM

P19.00007: Anti-Hermitian Contracted Schr{\"o}dinger Equation for the Determination of Ground-state Energies and Two-electron Reduced-density-matrices without Wavefunctions
David Mazziotti

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Wednesday, March 7, 2007
1:27PM - 1:39PM

P19.00008: A Near Linear-Scaling Smooth Local Coupled Cluster Algorithm for Electronic Structure
Joseph Subotnik , Alex Sodt , Martin Head-Gordon

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Wednesday, March 7, 2007
1:39PM - 1:51PM

P19.00009: Linear scaling integral fitting
Alexander Sodt , Martin Head-Gordon

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Wednesday, March 7, 2007
1:51PM - 2:03PM

P19.00010: New many-body approach to photoemission and spectral functions
Carl-Olof Almbladh , Claudio Verdozzi

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Wednesday, March 7, 2007
2:03PM - 2:15PM

P19.00011: Targeting individual excited states in DMRG.
Jonathan Dorando , Johannes Hachmann , Garnet Kin-Lic Chan

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