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The Journal of Physical Chemistry. A|August 16, 2016
Nonradiative Relaxation in Real-Time Electronic Dynamics OSCF2: Organolead Triiodide PerovskiteTriet S Nguyen, John Parkhill
Journal of Chemical Theory and Computation|November 18, 2015
Nonadiabatic Dynamics for Electrons at Second-Order: Real-Time TDDFT and OSCF2Triet S Nguyen, John Parkhill
The Journal of Chemical Physics|April 10, 2015
How electronic dynamics with Pauli exclusion produces Fermi-Dirac statisticsTriet S Nguyen, Ravindra Nanguneri, John Parkhill
Journal of Chemical Theory and Computation|July 21, 2017
Accelerating Realtime TDDFT with Block-Orthogonalized Manby-Miller Embedding TheoryKevin J Koh, Triet S Nguyen-Beck, John Parkhill
The Journal of Physical Chemistry Letters|April 12, 2016
Black-Box, Real-Time Simulations of Transient Absorption SpectroscopyTriet S Nguyen, Joong Hoon Koh, Susan Lefelhocz, et al.
Journal of the American Chemical Society|August 4, 2017
Origin of the Size-Dependent Stokes Shift in CsPbBr3 Perovskite NanocrystalsMichael C Brennan, John E Herr, Triet S Nguyen-Beck, et al.
Journal of Chemical Theory and Computation|January 27, 2016
Kinetic Energy of Hydrocarbons as a Function of Electron Density and Convolutional Neural NetworksKun Yao, John Parkhill
The Journal of Chemical Physics|January 9, 2017
The many-body expansion combined with neural networksKun Yao, John E Herr, John Parkhill
The Journal of Chemical Physics|October 27, 2016
Cost-effective description of strong correlation: Efficient implementations of the perfect quadruples and perfect hextuples modelsSusi Lehtola, John Parkhill, Martin Head-Gordon
Frontiers in Chemistry|May 3, 2014
Force-field functor theory: classical force-fields which reproduce equilibrium quantum distributionsRyan Babbush, John Parkhill, Alán Aspuru-Guzik
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