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The Journal of Physical Chemistry Letters|October 6, 2021
Exciton Condensation in Molecular-Scale van der Waals StacksAnna O Schouten, LeeAnn M Sager, David A Mazziotti
The Journal of Chemical Physics|January 28, 2012
Strongly correlated barriers to rotation from parametric two-electron reduced-density-matrix methods in application to the isomerization of diazeneAndrew M Sand, Christine A Schwerdtfeger, David A Mazziotti
The Journal of Physical Chemistry. A|February 20, 2013
Relative energies and geometries of the cis- and trans-HO3 radicals from the parametric 2-electron density matrix methodErik P Hoy, Christine A Schwerdtfeger, David A Mazziotti
The Journal of Physical Chemistry. A|July 13, 2023
Qubit Condensation for Assessing Efficacy of Molecular Simulation on Quantum ComputersLeeAnn M Sager-Smith, Scott E Smart, David A Mazziotti
Journal of Computational Chemistry|June 15, 2012
Comment on "Density functional theory study of 1,2-dioxetanone decomposition in condensed phase"Daniel Roca-Sanjuán, Marcus Lundberg, David A Mazziotti, et al.
The Journal of Physical Chemistry. A|April 14, 2017
Orbitals, Occupation Numbers, and Band Structure of Short One-Dimensional Cadmium Telluride PolymersAndrew J S Valentine, Dmitri V Talapin, David A Mazziotti
Physical Chemistry Chemical Physics : PCCP|October 26, 2019
Signature of van der Waals interactions in the cumulant density matrixOlivia Werba, Alexandra Raeber, Kade Head-Marsden, et al.
The Journal of Physical Chemistry. A|August 16, 2024
Lifetime of Strongly Correlated States on Near-Term Quantum ComputersLillian I Payne Torres, Anna O Schouten, David A Mazziotti
The Journal of Physical Chemistry Letters|May 30, 2020
Entangled Electrons Drive a Non-superexchange Mechanism in a Cobalt Quinoid Dimer ComplexJan-Niklas Boyn, Jiaze Xie, John S Anderson, et al.
Physical Review Letters|September 6, 2024
Exact Ansatz of Fermion-Boson Systems for a Quantum DeviceSamuel Warren, Yuchen Wang, Carlos L Benavides-Riveros, et al.
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