Nonadiabatic Molecular Dynamics with Fermionic Subspace-Expansion Algorithms on Quantum Computers
- Anthony Gandon
- Alberto Baiardi
- et al.
- 2024
- JCTC
Publications
14 results for Pauline J. Ollitrault
Quantum algorithms for quantum dynamics
- Alexander Miessen
- Pauline J. Ollitrault
- et al.
- 2022
- Nat. Comput. Sci.
One-particle Green's functions from the quantum equation of motion algorithm
- Jacopo Rizzo
- Francesco Libbi
- et al.
- 2022
- PRResearch
Molecular Quantum Dynamics: A Quantum Computing Perspective
- Pauline J. Ollitrault
- Alexander Miessen
- et al.
- 2021
- Accounts of Chemical Research
Improved Accuracy on Noisy Devices by Nonunitary Variational Quantum Eigensolver for Chemistry Applications
- Francesco Benfenati
- Guglielmo Mazzola
- et al.
- 2021
- JCTC
Quantum algorithm for alchemical optimization in material design
- Panagiotis Kl. Barkoutsos
- Fotios Gkritsis
- et al.
- 2021
- Chemical Science
Quantum HF/DFT-embedding algorithms for electronic structure calculations: Scaling up to complex molecular systems
- Max Rossmannek
- Panagiotis Kl. Barkoutsos
- et al.
- 2021
- Journal of Chemical Physics
Nonadiabatic Molecular Quantum Dynamics with Quantum Computers
- Pauline J. Ollitrault
- Guglielmo Mazzola
- et al.
- 2020
- Physical Review Letters
Quantum equation of motion for computing molecular excitation energies on a noisy quantum processor
- Pauline J. Ollitrault
- Abhinav Kandala
- et al.
- 2020
- PRResearch
Hardware efficient quantum algorithms for vibrational structure calculations
- Pauline J. Ollitrault
- Alberto Baiardi
- et al.
- 2020
- Chemical Science