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The Journal of Chemical Physics|May 7, 2022
Selected configuration interaction wave functions in phaseless auxiliary field quantum Monte CarloAnkit Mahajan, Joonho Lee, Sandeep SharmaJournal of Chemical Theory and Computation|October 7, 2025
Gaussian-Based Periodic Grand Canonical Density Functional Theory with Implicit Solvation for Computational ElectrochemistryAnton Z Ni, Adam Rettig, Joonho LeeJournal of Chemical Theory and Computation|August 16, 2023
Even Faster Exact Exchange for Solids via Tensor HypercontractionAdam Rettig, Joonho Lee, Martin Head-GordonJournal of Chemical Theory and Computation|February 15, 2022
Compressing Many-Body Fermion Operators under Unitary ConstraintsNicholas C Rubin, Joonho Lee, Ryan BabbushMaterials (Basel, Switzerland)|June 2, 2021
Phase Diagram of Binary Alloy Nanoparticles under High PressureHan Gyeol Kim, Joonho Lee, Guy MakovJournal of Chemical Theory and Computation|December 4, 2019
Systematically Improvable Tensor Hypercontraction: Interpolative Separable Density-Fitting for Molecules Applied to Exact Exchange, Second- and Third-Order Møller-Plesset Perturbation TheoryJoonho Lee, Lin Lin, Martin Head-GordonThe Journal of Physical Chemistry Letters|July 2, 2019
Third-Order Møller-Plesset Perturbation Theory Made Useful? Choice of Orbitals and Scaling Greatly Improves Accuracy for Thermochemistry, Kinetics, and Intermolecular InteractionsLuke W Bertels, Joonho Lee, Martin Head-GordonJournal of Chemical Theory and Computation|January 6, 2021
Polishing the Gold Standard: The Role of Orbital Choice in CCSD(T) Vibrational Frequency PredictionLuke W Bertels, Joonho Lee, Martin Head-GordonThe Journal of Chemical Physics|December 12, 2019
Excited states via coupled cluster theory without equation-of-motion methods: Seeking higher roots with application to doubly excited states and double core hole statesJoonho Lee, David W Small, Martin Head-GordonFrontiers in Neurology|January 22, 2025
Impact of A1 segment asymmetry on hemodynamic conditions around the circle of Willis and anterior communicating artery aneurysm formationJoonho Lee, Seul-Ki Jeong, Ji Man HongPageof 19