Levy-Lieb embedding of density-functional theory and its quantum kernel: Illustration for the Hubbard dimer using near-term quantum algorithms
- Das Pemmaraju
- Amol Deshmukh
- 2022
- Physical Review A
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71 results for Quantum Use Cases
Quantum computation of dominant products in lithium-sulfur batteries
- Julia E. Rice
- Tanvi P. Gujarati
- et al.
- 2021
- Journal of Chemical Physics
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
Computational investigations of the lithium superoxide dimer rearrangement on noisy quantum devices
- Qi Gao
- Jeannette M. Garcia
- et al.
- 2021
- Journal of Physical Chemistry A
Quantum simulation of electronic structure with a transcorrelated Hamiltonian: Improved accuracy with a smaller footprint on the quantum computer
- Mario Motta
- Tanvi P. Gujarati
- et al.
- 2020
- Physical Chemistry Chemical Physics
Toward scalable simulations of lattice gauge theories on quantum computers
- Simon V. Mathis
- Guglielmo Mazzola
- et al.
- 2020
- Physical Review D
Quantum Algorithms for Quantum Chemistry and Quantum Materials Science
- Bela Bauer
- Sergey Bravyi
- et al.
- 2020
- Chemical Reviews
Entanglement production and convergence properties of the variational quantum eigensolver
- Andreas J.C. Woitzik
- Panagiotis Kl. Barkoutsos
- et al.
- 2020
- Physical Review A
Reducing Qubit Requirements for Quantum Simulations Using Molecular Point Group Symmetries
- Kanav Setia
- Richard Chen
- et al.
- 2020
- JCTC
Quantum orbital-optimized unitary coupled cluster methods in the strongly correlated regime: Can quantum algorithms outperform their classical equivalents?
- Igor O. Sokolov
- Panagiotis Kl. Barkoutsos
- et al.
- 2020
- Journal of Chemical Physics