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Journal of Chemical Theory and Computation|April 17, 2026
Quantum Gambling: Best-Arm Strategies for Generator Selection in Adaptive Variational AlgorithmsRick Huang, Artur F IzmaylovJournal of Chemical Theory and Computation|April 7, 2026
Quantum Seniority-Based Subspace Expansion: Linear Combinations of Short-Circuit Unitary Transformations for the Electronic Structure ProblemSmik Patel, Praveen Jayakumar, Rick Huang, et al.The Journal of Chemical Physics|March 22, 2013
Perturbative wave-packet spawning procedure for non-adiabatic dynamics in diabatic representationArtur F IzmaylovThe Journal of Physical Chemistry. A|March 28, 2019
On Construction of Projection OperatorsArtur F IzmaylovJournal of Chemical Theory and Computation|November 10, 2025
Planted Solutions in Quantum Chemistry: Generating Non-Trivial Hamiltonians with Known Ground StatesLinjun Wang, Joshua T Cantin, Smik Patel, et al.The Journal of Physical Chemistry Letters|December 21, 2017
Topological Origins of Bound States in the Continuum for Systems with Conical IntersectionsSarah Henshaw, Artur F IzmaylovJournal of Chemical Theory and Computation|May 24, 2023
Measurement Optimization Techniques for Excited Electronic States in Near-Term Quantum Computing AlgorithmsSeonghoon Choi, Artur F IzmaylovThe Journal of Chemical Physics|December 12, 2018
On the breakdown of the Ehrenfest method for molecular dynamics on surfacesIgnacio Loaiza, Artur F IzmaylovPhysical Review Letters|January 15, 2011
Active-space N-representability constraints for variational two-particle reduced density matrix calculationsNeil Shenvi, Artur F IzmaylovJournal of Chemical Theory and Computation|December 14, 2016
Entanglement in the Born-Oppenheimer ApproximationArtur F Izmaylov, Ignacio FrancoPageof 11