Wednesday, March 7, 2018
8:00AM - 8:36AM
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K29.00001: Embedded many-body perturbation theory for organic and hybrid disordered systems
Invited Speaker:
Xavier Blase
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Wednesday, March 7, 2018
8:36AM - 8:48AM
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K29.00002: The predictive power of “one-shot” GW calculations for halide perovskites
Linn Leppert, Tonatiuh Rangel Gordillo, Jonah Haber, Jeffrey Neaton
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Wednesday, March 7, 2018
8:48AM - 9:00AM
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K29.00003: Many-Body Perturbation Theory for molecules: Physicists' approach versus Chemists' approach
Fabien Bruneval
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Wednesday, March 7, 2018
9:00AM - 9:12AM
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K29.00004: Understanding The Structure-function Relation In Natural Dyes
MARIAMI RUSISHVILI, Sara Laporte, Luca Grisanti, Alessandra Magistrato, Stefano Baroni
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Wednesday, March 7, 2018
9:12AM - 9:24AM
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K29.00005: Tuning Optical Properties of Dibenzochrysenes by Functionalization: A Many-Body Perturbation Theory Study
Nicolas Dardenne, Roberto Cardia, Jing Li, Giuliano Malloci, Giancarlo Cappellini, Xavier Blase, Jean-Christophe Charlier, Gian-Marco Rignanese
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Wednesday, March 7, 2018
9:24AM - 9:36AM
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K29.00006: Geometry Distortion and Small Polaron Binding Energy Changes with Ionic Substitution in Halide Perovskites
Amanda Neukirch, Liujiang Zhou, Iwnetim Abate, Jacky Even, Sergei Tretiak
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Wednesday, March 7, 2018
9:36AM - 9:48AM
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K29.00007: Phenyl-Substituted Acene Derivatives as Candidates for Intermolecular Singlet Fission
Xingyu Liu, Xiaopeng Wang, Cameron Cook, Bohdan Schatschneider, Noa Marom
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Wednesday, March 7, 2018
9:48AM - 10:00AM
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K29.00008: On the Possibility of Singlet Fission in Crystalline Quaterrylene
Xiaopeng Wang, Xingyu Liu, Cameron Cook, Bohdan Schatschneider, Noa Marom
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Wednesday, March 7, 2018
10:00AM - 10:12AM
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K29.00009: Charge transfer and singlet fission quantum dynamics in organic photovoltaics
Pengfei Huo, Sharma Yamijala
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Wednesday, March 7, 2018
10:12AM - 10:24AM
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K29.00010: Quasiparticle excitations of molecular chains on graphene
Johannes Lischner, Hsin-Zon Tsai, Jiong Lu, Arash Omrani, Kenji Watanabe, Takashi Taniguchi, Steven Louie, Alex Zettl, Michael Crommie
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Wednesday, March 7, 2018
10:24AM - 10:36AM
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K29.00011: Many-body perturbation theory analysis of point defects in bulk and monolayer semiconducting materials
Kirk Lewis, Sahar Sharifzadeh
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Wednesday, March 7, 2018
10:36AM - 10:48AM
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K29.00012: First-principles Engineering of Charged Defects for Two-dimensional Quantum Technologies
Yuan Ping, Ravishankar Sundararaman, Dario Rocca, Feng Wu
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Wednesday, March 7, 2018
10:48AM - 11:00AM
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K29.00013: Efficiently Capturing Substrate Screening Effects on Level Alignments at Molecule-Metal Interfaces with GW Calculations
Zhenfei Liu, Felipe H. da Jornada, Steven Louie, Jeffrey Neaton
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