126 citations · 272 across the 9 of their papers we have counts for
9 papers
HarperValleyBank: A Domain-Specific Spoken Dialog Corpus
Mike Wu, Jonathan Nafziger, Anthony Scodary +1
We introduce HarperValleyBank, a free, public domain spoken dialog corpus. The data simulate simple consumer banking interactions, containing about 23 hours of audio from 1,446 hum…
Chemical Potential of Integer Electron Systems
Kelsie NIffenegger, Yan Oueis, Jonathan Nafziger +1
A truly isolated atom always has an integer number of electrons. If placed in contact with a far-away metallic reservoir, a {\em range} of metallic chemical potentials will lea…
Constructing a Non-additive Non-interacting Kinetic Energy Functional Approximation for Covalent Bonds from Exact Conditions
Kaili Jiang, Jonathan Nafziger, Adam Wasserman
We present a non-decomposable approximation for the non-additive non-interacting kinetic energy (NAKE) for covalent bonds based on the exact behavior of the von Weizsäcker (vW) fun…
Non-additive Non-interacting Kinetic Energy of Rare Gas Dimers
Kaili Jiang, Jonathan Nafziger, Adam Wasserman
Approximations of the non-additive non-interacting kinetic energy (NAKE) as an explicit functional of the density are the basis of several electronic structure methods that provide…
The Importance of being consistent
Adam Wasserman, Jonathan Nafziger, Kaili Jiang +3
We review the role of self-consistency in density functional theory. We apply a recent analysis to both Kohn-Sham and orbital-free DFT, as well as to Partition-DFT, which generaliz…
Partition-DFT on the Water Dimer
Sara Gómez, Jonathan Nafziger, Albeiro Restrepo +1
As is well known, the ground-state symmetry group of the water dimer switches from its equilibrium -character to -character as the distance between the two oxygen at…
Accurate Reference Data for the Non-Additive Non-Interacting Kinetic Energy in Covalent Bonds
Jonathan Nafziger, Kaili Jiang, Adam Wasserman
The non-additive non-interacting kinetic energy is calculated exactly for fragments of H, Li, Be, C, N, F, and Na within partition density-functional th…
Fragment-based Treatment of Delocalization and Static Correlation Errors in Density-Functional Theory
Jonathan Nafziger, Adam Wasserman
One of the most important open challenges in modern Kohn-Sham (KS) density-functional theory (DFT) is the correct treatment of fractional electron charges and spins. Approximate ex…
Molecular Binding Energies from Partition Density Functional Theory
Jonathan Nafziger, Qin Wu, Adam Wasserman
Approximate molecular calculations via standard Kohn-Sham Density Functional Theory are exactly reproduced by performing self-consistent calculations on isolated fragments via Part…