Thursday, March 8, 2018
11:15AM - 11:51AM
|
|
S02.00001: Non-adiabatic dynamics on a single time-dependent potential energy surface
Invited Speaker:
Eberhard K Gross
|
Thursday, March 8, 2018
11:51AM - 12:03PM
|
|
S02.00002: Globally-Optimized Local Pseudopotentials for (Orbital-Free) Density Functional Theory Simulations of Liquids and Solids
Beatriz Gonzalez del Rio, Johannes Dieterich, Emily Carter
|
Thursday, March 8, 2018
12:03PM - 12:15PM
|
|
S02.00003: van Leeuwen Theorem for Mixed States and Finite Temperature Density Response
James Dufty, Kai Luo, Sam Trickey
|
Thursday, March 8, 2018
12:15PM - 12:27PM
|
|
S02.00004: Even-handed subsystem selection in projection-based wavefunction-in-DFT embedding
Matthew Welborn, Thomas Miller
|
Thursday, March 8, 2018
12:27PM - 12:39PM
|
|
S02.00005: A study of accurate exchange-correlation functionals through adiabatic connection
Manoj Harbola, Rabeet Singh
|
Thursday, March 8, 2018
12:39PM - 12:51PM
|
|
S02.00006: Development of Effective Stochastic Kohn-Sham Potential Method using Random Matrix Theory for Performing DFT Calculations on Noisy Chemical Systems
Arindam Chakraborty
|
Thursday, March 8, 2018
12:51PM - 1:03PM
|
|
S02.00007: Strong correlation in time-dependent density functional theory
Kieron Burke, Diego Carrascal, Jaime Ferrer, Neepa Maitra
|
Thursday, March 8, 2018
1:03PM - 1:15PM
|
|
S02.00008: Fluctuations in density-functional theory for fluids: Theory and computations
Miguel Angel Duran-Olivencia, Petr Yatsyshin, Antonio Russo, Serafim Kalliadasis
|
Thursday, March 8, 2018
1:15PM - 1:27PM
|
|
S02.00009: Understanding interfacial wetting transitions with classical density functional theory
Petr Yatsyshin, Miguel Angel Duran-Olivencia, Andrew Parry, Carlos Rascon, Serafim Kalliadasis
|
Thursday, March 8, 2018
1:27PM - 1:39PM
|
|
S02.00010: Zero-point motion of molecules: beyond Born-Oppenheimer
Grigory Kolesov, Efthimios Kaxiras, Efstratios Manousakis
|
Thursday, March 8, 2018
1:39PM - 1:51PM
|
|
S02.00011: Efficient Implementation of the Approximate Exchange Kernel Method
Guo Chen, Matthew Agee, Filipp Furche
|
Thursday, March 8, 2018
1:51PM - 2:03PM
|
|
S02.00012: The SCAN Meta-GGA : An Efficient Universal Non-Empirical Semi-local Density Functional
Jianwei Sun
|
Thursday, March 8, 2018
2:03PM - 2:15PM
|
|
S02.00013: A Novel Generalized Gradient Approximation for the Non-interacting Kinetic Energy Density Functional
Kai Luo, Valentin Karasiev, Sam Trickey
|
