Thursday, March 7, 2019
8:00AM - 8:36AM
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R31.00001: Auxiliary-field quantum Monte Carlo calculations for periodic solids with Brillouin zone sampling
Invited Speaker:
Mario Motta
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Thursday, March 7, 2019
8:36AM - 8:48AM
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R31.00002: Auxiliary Field Quantum Monte Carlo Simulations of Real Strongly Correlated Materials
Fionn Malone, Shuai Zhang, Miguel Morales
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Thursday, March 7, 2019
8:48AM - 9:00AM
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R31.00003: Diffusion Monte Carlo study of hydrogen adsorption on silicon carbide nanotube
Genki Imam Prayogo, Kenta Hongo, Hyeondeok Shin, Ryo Maezono, Anouar Benali
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Thursday, March 7, 2019
9:00AM - 9:12AM
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R31.00004: Band gaps and excitons in quantum Monte Carlo
Michael Bennett, Matej Ditte, Cody Melton, Matus Dubecky, Lubos Mitas
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Thursday, March 7, 2019
9:12AM - 9:48AM
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R31.00005: Ab Initio Finite Temperature Auxiliary Field Quantum Monte Carlo for Solids
Invited Speaker:
Brenda Rubenstein
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Thursday, March 7, 2019
9:48AM - 10:00AM
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R31.00006: Multi-determinant Diffusion Monte Carlo in solids at the thermodynamic limit
Kevin Gasperich, Thomas Applencourt, Ye Luo, Qiming Sun, Kenneth D Jordan, Luke Shulenburger, Anthony Scemama, Michel Caffarel, Anouar Benali
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Thursday, March 7, 2019
10:00AM - 10:12AM
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R31.00007: Progress towards finite temperature density matrix quantum Monte Carlo calculations on solids
Hayley Petras, James Shepherd
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Thursday, March 7, 2019
10:12AM - 10:24AM
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R31.00008: Difficulty to capture non-additive enhancement of stacking energy by conventional ab initio methods
Ken Qin, Tomohiro Ichibha, Kenta Hongo, Ryo Maezono
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Thursday, March 7, 2019
10:24AM - 10:36AM
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R31.00009: A simpler twist averaging for the uniform electron gas designed for finite basis set calculations such as coupled cluster and full configuration interaction quantum Monte Carlo
Tina Mihm, Alexandra McIsaac, James Shepherd
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Thursday, March 7, 2019
10:36AM - 10:48AM
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R31.00010: A diffusion Monte Carlo study of point defect diffusion in rutile TiO2 bulk
Tom Ichibha, Anouar Benali, Kenta Hongo, Ryo Maezono
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