Monday, March 5, 2018
8:00AM - 8:36AM
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A34.00001: Accurate, scalable computations in many-electron systems
Invited Speaker:
Shiwei Zhang
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Monday, March 5, 2018
8:36AM - 8:48AM
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A34.00002: Stacking Interactions of B-DNA and Their Nonadditivities: A QMC Study
Ken Qin, Ryo Maezono, Kenta Hongo
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Monday, March 5, 2018
8:48AM - 9:00AM
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A34.00003: Calculating the force constant matrix via quantum Monte Carlo
Yu Yang Liu, Bartholomew Andrews, Gareth Conduit
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Monday, March 5, 2018
9:00AM - 9:12AM
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A34.00004: Towards the solution of the many-electron problem in real materials:
equation of state of the hydrogen chain with state-of-the-art many-body methods
Mario Motta, David Ceperley, Garnet Chan, John Gomez, Emanuel Gull, Sheng Guo, Carlos Jiménez-Hoyos, Tran Lan, Jia Li, Fengjie Ma, Andrew Millis, Nikolai Prokof'ev, Ushnish Ray, Gustavo Scuseria, Sandro Sorella, Edwin Stoudenmire, Qiming Sun, Igor Tupitsyn, Steven White, Dominika Zgid, Shiwei Zhang
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Monday, March 5, 2018
9:12AM - 9:24AM
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A34.00005: Diffusion Monte Carlo Re-evaluation of Bulk Aluminium with QMCPACK
Adie Hanindriyo, Hyeondeok Shin, Anouar Benali, Ryo Maezono
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Monday, March 5, 2018
9:24AM - 9:36AM
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A34.00006: Accelerating Quantum Monte Carlo via Graphics Processing Units
Benjamin Himberg, Adrian Del Maestro
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Monday, March 5, 2018
9:36AM - 9:48AM
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A34.00007: Large-Scale GW Calculations on Pre-Exascale HPC Systems
Mauro Del Ben, Felipe H. da Jornada, Andrew Canning, Nathan Wichmann, Karthik Raman, Ruchira Sasanka, Chao Yang, Steven Louie, Jack Deslippe
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Monday, March 5, 2018
9:48AM - 10:00AM
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A34.00008: Tuning the Polaronic Properties of Hybrid Organic-Inorganic Perovskites CH3NH3PbI3 by Mixing Cation
Liujiang Zhou, Amanda J. Neukirch, Jacky Even, Claudine Katan, Sergei Tretiak
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Monday, March 5, 2018
10:00AM - 10:12AM
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A34.00009: HPC in Polymeric Materials: Unraveling the Morphologies of Miktoarm Star Terpolymers
Monojoy Goswami, Matthias Arras, Gregory Smith
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Monday, March 5, 2018
10:12AM - 10:24AM
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A34.00010: Creation of defects in nanograin tungsten
Yang Zhang, Jason Trelewicz, Predrag Krstic
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Monday, March 5, 2018
10:24AM - 10:36AM
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A34.00011: Three-Orbital Spin-Fermion Model for CuO2 Planes
Mostafa Hussein, Christopher Bishop, Elbio Dagotto, Adriana Moreo
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Monday, March 5, 2018
10:36AM - 10:48AM
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A34.00012: Angle-Adjustable Phase Field Crystal Method for Modeling Crystalline Microstructures
Zile Wang, Zhi-Rong Liu, Zhi Feng Huang
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Monday, March 5, 2018
10:48AM - 11:00AM
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A34.00013: Ground state critical exponents in disordered XYZ spin chain
Brenden Roberts, Olexei Motrunich
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