Luke W. Bertels
- NewtonNet: A Newtonian message passing network for deep learning of interatomic potentials and forces
2021/08/06 by Mojtaba Haghighatlari, Jie Li, Haghighatlari, Mojtaba +23 · 15 citations
Chemistry · Computer Science · Materials Science · #Chemical Physics (physics.chem-ph) #Computational Drug Discovery Methods #FOS: Physical sciences #Machine Learning in Materials Science #Various Chemistry Research Topics
- Quantum-Centric Algorithm for Sample-Based Krylov Diagonalization
2025/01/16 by Jeffery Yu, Javier Robledo Moreno, Yu, Jeffery +40 · 1 voice · 32 citations
Computer Science · Biochemistry, Genetics and Molecular Biology · #Quantum Computing Algorithms and Architecture #Neural Networks and Applications #Fractal and DNA sequence analysis
- Symmetry breaking slows convergence of the ADAPT Variational Quantum Eigensolver
2022/07/07 by Luke W. Bertels, Bertels, Luke W., Harper R. Grimsley +7 · 9 citations
Computer Science · Physics and Astronomy · #Atomic and Subatomic Physics Research #FOS: Physical sciences #Quantum Information and Cryptography #Quantum Physics (quant-ph) #Quantum and electron transport phenomena
- A Perspective on Quantum Computing Applications in Quantum Chemistry using 25--100 Logical Qubits
2025/06/24 by Yuri Alexeev, Victor S. Batista, Alexeev, Yuri +57 · 11 citations
Computer Science · #Quantum Computing Algorithms and Architecture #Quantum-Dot Cellular Automata #Quantum Information and Cryptography