Quantum solver of contracted eigenvalue equations for scalable molecular simulations on quantum computing devices SE Smart, DA Mazziotti
Physical Review Letters 126 (7), 070504, 2021
80 2021 Controlled step-wise isomerization of the Keggin-type Al 13 and determination of the γ-Al 13 structure SE Smart, J Vaughn, I Pappas, L Pan
Chemical Communications 49 (97), 11352-11354, 2013
66 2013 Quantum-classical hybrid algorithm using an error-mitigating -representability condition to compute the Mott metal-insulator transition SE Smart, DA Mazziotti
Physical Review A 100 (2), 022517, 2019
61 2019 Preparation of an exciton condensate of photons on a 53-qubit quantum computer LAM Sager, SE Smart, DA Mazziotti
Physical Review Research 2 (4), 043205, 2020
34 2020 Resolving correlated states of benzyne with an error-mitigated contracted quantum eigensolver SE Smart, JN Boyn, DA Mazziotti
Physical Review A 105 (2), 022405, 2022
31 2022 Isomerization of Keggin Al13 Ions Followed by Diffusion Rates AF Oliveri, CA Colla, CK Perkins, N Akhavantabib, JR Callahan, ...
Chemistry–A European Journal 22 (52), 18682-18685, 2016
27 2016 Characterization of Al30 in commercial poly-aluminum chlorohydrate by solid-state 27Al NMR spectroscopy BL Phillips, JS Vaughn, S Smart, L Pan
Journal of colloid and interface science 476, 230-239, 2016
25 2016 Quantum-classical hybrid algorithm for the simulation of all-electron correlation JN Boyn, AO Lykhin, SE Smart, L Gagliardi, DA Mazziotti
The Journal of Chemical Physics 155 (24), 2021
23 2021 Experimental data from a quantum computer verifies the generalized Pauli exclusion principle SE Smart, DI Schuster, DA Mazziotti
Communications Physics 2 (1), 11, 2019
23 2019 Relaxation of stationary states on a quantum computer yields a unique spectroscopic fingerprint of the computer’s noise SE Smart, Z Hu, S Kais, DA Mazziotti
Communications Physics 5 (1), 28, 2022
17 2022 Solid-State 27 Al NMR Spectroscopy of the γ-Al13 Keggin Containing Al Coordinated by a Terminal Hydroxyl Ligand BL Phillips, CA Ohlin, J Vaughn, W Woerner, S Smart, R Subramanyam, ...
Inorganic chemistry 55 (23), 12270-12280, 2016
16 2016 Efficient two-electron ansatz for benchmarking quantum chemistry on a quantum computer SE Smart, DA Mazziotti
Physical Review Research 2 (2), 023048, 2020
15 2020 Quantum Simulation of Molecules without Fermionic Encoding of the Wave Function DA Mazziotti, SE Smart, AR Mazziotti
arXiv preprint arXiv:2101.11607, 2021
14 2021 Lowering tomography costs in quantum simulation with a symmetry projected operator basis SE Smart, DA Mazziotti
Physical Review A 103 (1), 012420, 2021
13 2021 Ultrathin hybrid films of polyoxohydroxy clusters and proteins: layer-by-layer assembly and their optical and mechanical properties YX Yan, HB Yao, SE Smart, LB Mao, W Hu, S Yuan, L Du-Thumm, ...
Langmuir 30 (18), 5248-5255, 2014
12 2014 Many-fermion simulation from the contracted quantum eigensolver without fermionic encoding of the wave function SE Smart, DA Mazziotti
Physical Review A 105 (6), 062424, 2022
11 2022 Accelerated Convergence of Contracted Quantum Eigensolvers through a Quasi-Second-Order, Locally Parameterized Optimization SE Smart, DA Mazziotti
Journal of Chemical Theory and Computation 18 (9), 5286-5296, 2022
8 2022 Using reduced density matrix techniques to capture static and dynamic correlation in the energy landscape for the decomposition of the CH2CH2ONO radical and support a non-IRC … SE Smart, PG Scrape, LJ Butler, DA Mazziotti
The Journal of Chemical Physics 149 (2), 2018
7 2018 Stabilization of cationic aluminum hydroxide clusters in high pH environments with a CaCl 2/l-arginine matrix SE Smart, V Dubovoy, L Pan
Chemical Communications 55 (43), 5998-6001, 2019
5 2019 Verifiably exact solution of the electronic Schrödinger equation on quantum devices SE Smart, DA Mazziotti
Physical Review A 109 (2), 022802, 2024
4 2024