2 citations · 3 across the 2 of their papers we have counts for
Showing quant-phShow all
2 papers · 1 filter
quant-ph2024★ 2 cited
Enhancing initial state overlap through orbital optimization for faster molecular electronic ground-state energy estimation
Pauline J. Ollitrault, Cristian L. Cortes, Jerome F. Gonthier +7
The quantum phase estimation algorithm stands as the primary method for determining the ground state energy of a molecular electronic Hamiltonian on a quantum computer. In this con…
quant-ph2021★ 1 cited
Towards the Simulation of Large Scale Protein-Ligand Interactions on NISQ-era Quantum Computers
Fionn D. Malone, Robert M. Parrish, Alicia R. Welden +6
We explore the use of symmetry-adapted perturbation theory (SAPT) as a simple and efficient means to compute interaction energies between large molecular systems with a hybrid meth…