Bulletin of the American Physical Society

APS March Meeting 2016

Volume 61, Number 2

Monday–Friday, March 14–18, 2016; Baltimore, Maryland

Session Index

Session H31: Advances in Density Functional Theory IV

Focus Session

Show Abstracts

Sponsoring Units: DCP
Chair: Adam Wasserman, Purdue University
Room: 331

Tuesday, March 15, 2016 2:30PM - 3:06PM		H31.00001: Extensions of time density functional theory to QED: QED-Chemistry Invited Speaker: Angel Rubio Preview Abstract
Tuesday, March 15, 2016 3:06PM - 3:18PM		H31.00002: Advances in time-dependent current-density functional theory Arjan Berger Preview Abstract
Tuesday, March 15, 2016 3:18PM - 3:30PM		H31.00003: The particle-particle random phase approximation and beyond -- insight from the superconductive Gorkov perspective and implications of an efficient truncation scheme Du Zhang, Weitao Yang Preview Abstract
Tuesday, March 15, 2016 3:30PM - 3:42PM		H31.00004: Calculating excitation energies with particle-particle and particle-hole random phase approximation using accurate optimized effective potentials Ye Jin, Yang Yang, Degao Peng, Weitao Yang Preview Abstract
Tuesday, March 15, 2016 3:42PM - 3:54PM		H31.00005: Singlet--Triplet Energy Gaps for Diradicals from Particle--Particle Random Phase Approximation Yang Yang, Degao Peng, Ernest Davidson, Weitao Yang Preview Abstract
Tuesday, March 15, 2016 3:54PM - 4:06PM		H31.00006: Thermal connection formula and linear response time-dependent density functional theory for thermal ensembles Aurora Pribram-Jones, Paul Grabowski, Kieron Burke Preview Abstract
Tuesday, March 15, 2016 4:06PM - 4:18PM		H31.00007: Solid-state optical absorption from optimally tuned time-dependent range-separated hybrid density functional theory Sivan Refaely-Abramson, Manish Jain, Sahar Sharifzadeh, Jeffrey B. Neaton, Leeor Kronik Preview Abstract
Tuesday, March 15, 2016 4:18PM - 4:30PM		H31.00008: Exploring Level Alignment in Molecule-Metal Interfaces with Optimally-Tuned Range-Separated Hybrid Functionals Zhenfei Liu, David A. Egger, Sivan Refaely-Abramson, Leeor Kronik, Jeffrey B. Neaton Preview Abstract
Tuesday, March 15, 2016 4:30PM - 4:42PM		H31.00009: Chemically accurate description of aromatic rings interaction using quantum Monte Carlo Sam Azadi Preview Abstract
Tuesday, March 15, 2016 4:42PM - 4:54PM		H31.00010: Study of a Quantum Dot in an Excited State Marlina Slamet, Viraht Sahni Preview Abstract
Tuesday, March 15, 2016 4:54PM - 5:06PM		H31.00011: First-principles photoemission spectroscopy in DNA and RNA nucleobases from Koopmans-compliant functionals Ngoc Linh Nguyen, Giovanni Borghi, Andrea Ferretti, Nicola Marzari Preview Abstract
Tuesday, March 15, 2016 5:06PM - 5:18PM		H31.00012: van der Waals Density Functional Theory vdW-DFq for Semihard Materials Qing Peng, Suvranu De Preview Abstract
Tuesday, March 15, 2016 5:18PM - 5:30PM		H31.00013: A non-empirical, parameter-free, hybrid functional for accurate calculations of optoelectronic properties of finite systems Nicholas Brawand, M\'arton V\"or\"os, Marco Govoni, Giulia Galli Preview Abstract

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Bulletin of the American Physical Society

APS March Meeting 2016

Volume 61, Number 2

Monday–Friday, March 14–18, 2016; Baltimore, Maryland

Session Index

Session H31: Advances in Density Functional Theory IV

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