98 citations · 248 across the 9 of their papers we have counts for
10 papers
A Practical Introduction to VQE: Methods, Challenges, and Applications in Physics and Chemistry
Jannis Ehrlich, Felix Rupprecht, Konstantin Lamp +6
The Variational Quantum Eigensolver (VQE) has become a central hybrid quantum-classical method for addressing electronic structure and materials science problems on near-term quant…
Optimizing Subspace Expansion in Quantum Chemistry through Operator Selection and Reference State Choice
Konstantin Lamp, Alejandro D. Somoza, Elias Walter +4
The Virtual Quantum Subspace Expansion (VQSE) extends the Variational Quantum Eigensolver (VQE) by leveraging additional measurements on the reference state to capture the influenc…
Simulating Electron Transfer on Noisy Quantum Computers
Marvin Gajewski, Alejandro D. Somoza, Gary Schmiedinghoff +3
While simple spin-boson models have been realized on quantum hardware, simulating extended electronic networks with local vibrational environments remains a fundamental challenge i…
Nonlinear dynamics as a ground-state solution on quantum computers
Albert J. Pool, Alejandro D. Somoza, Conor Mc Keever +2
For the solution of time-dependent nonlinear differential equations, we present variational quantum algorithms (VQAs) that encode both space and time in qubit registers. The spacet…
Driving Force and Nonequilibrium Vibronic Dynamics in Charge Separation of Strongly Bound Electron-Hole Pairs
Alejandro D. Somoza, Nicola Lorenzoni, James Lim +2
Electron-hole pairs in organic photovoltaics dissociate efficiently despite their Coulomb-binding energy exceeding thermal energy at room temperature. The electronic states involve…
Dissipation-assisted matrix product factorization
Alejandro D. Somoza, Oliver Marty, James Lim +2
Charge and energy transfer in biological and synthetic organic materials are strongly influenced by the coupling of electronic states to high-frequency underdamped vibrations under…