Quantum-centric supercomputing for materials science: A perspective on challenges and future directions
- Yuri Alexeev
- Maximilian Amsler
- et al.
- 2024
- Future Generation Computer Systems
Publications
51 results for Barbara A. Jones
Quantum computation of reactions on surfaces using local embedding
- Tanvi P. Gujarati
- Mario Motta
- et al.
- 2023
- npj Quantum Information
Quantum Circuits for the Preparation of Spin Eigenfunctions on Quantum Computers
- Alessandro Carbone
- Davide Emilio Galli
- et al.
- 2022
- Symmetry
Minimal effective Gibbs ansatz: A simple protocol for extracting an accurate thermal representation for quantum simulation
- J. Cohn
- F. Yang
- et al.
- 2020
- Physical Review A
Activated layered magnetism from bulk TiN
- Chiung Yuan Lin
- Szu Wen Yang
- et al.
- 2019
- Physical Review Materials
Heusler compounds with perpendicular magnetic anisotropy and large tunneling magnetoresistance
- Sergey V. Faleev
- Yari Ferrante
- et al.
- 2017
- Physical Review Materials
Origin of the Tetragonal Ground State of Heusler Compounds
- Sergey V. Faleev
- Yari Ferrante
- et al.
- 2017
- Physical Review Applied
Unified explanation of chemical ordering, the Slater-Pauling rule, and half-metallicity in full Heusler compounds
- Sergey V. Faleev
- Yari Ferrante
- et al.
- 2017
- Physical Review B
Origin of Perpendicular Magnetic Anisotropy and Large Orbital Moment in Fe Atoms on MgO
- Susanne Baumann
- Fabio Donati
- et al.
- 2015
- Physical Review Letters
Statistical mechanics and thermodynamics of viral evolution
- Barbara A. Jones
- Justin Lessler
- et al.
- 2015
- PLoS ONE