activity
20122024
most citedHeat-bath Configuration Interaction: An efficient selected CI algorithm inspired by heat-bath sampling

506 citations · 601 across the 12 of their papers we have counts for

collaborators

12 papers

quant-ph20242 cited

Bayesian Optimization Priors for Efficient Variational Quantum Algorithms

Farshud Sorourifar, Diana Chamaki, Norm M. Tubman +2

Quantum computers currently rely on a hybrid quantum-classical approach known as Variational Quantum Algorithms (VQAs) to solve problems. Still, there are several challenges with V…

physics.chem-ph2024

Quantum Hardware-Enabled Molecular Dynamics via Transfer Learning

Abid Khan, Prateek Vaish, Yaoqi Pang +8

The ability to perform ab initio molecular dynamics simulations using potential energies calculated on quantum computers would allow virtually exact dynamics for chemical and bioch…

quant-ph20243 cited

Surrogate optimization of variational quantum circuits

Erik J. Gustafson, Juha Tiihonen, Diana Chamaki +8

Variational quantum eigensolvers are touted as a near-term algorithm capable of impacting many applications. However, the potential has not yet been realized, with few claims of qu…

quant-ph202310 cited

Pre-optimizing variational quantum eigensolvers with tensor networks

Abid Khan, Bryan K. Clark, Norm M. Tubman

The variational quantum eigensolver (VQE) is a promising algorithm for demonstrating quantum advantage in the noisy intermediate-scale quantum (NISQ) era. However, optimizing VQE f…

physics.chem-ph202315 cited

A Parallel, Distributed Memory Implementation of the Adaptive Sampling Configuration Interaction Method

David B. Williams-Young, Norm M. Tubman, Carlos Mejuto-Zaera +1

Many-body simulations of quantum systems is an active field of research that involves many different methods targeting various computing platforms. Many methods commonly employed,…

quant-ph20237 cited

Large-scale sparse wavefunction circuit simulator for applications with the variational quantum eigensolver

J. Wayne Mullinax, Norm M. Tubman

The standard paradigm for state preparation on quantum computers for the simulation of physical systems in the near term has been widely explored with different algorithmic methods…