3 citations · 4 across the 3 of their papers we have counts for
3 papers
QB Ground State Energy Estimation Benchmark
Nicole Bellonzi, Joshua T. Cantin, Mohammad Reza Jangrouei +14
Ground State Energy Estimation (GSEE) is a central problem in quantum chemistry and condensed matter physics, demanding efficient algorithms to solve complex electronic structure c…
Feasibility of accelerating homogeneous catalyst discovery with fault-tolerant quantum computers
Nicole Bellonzi, Alexander Kunitsa, Joshua T. Cantin +16
The industrial manufacturing of chemicals consumes a significant amount of energy and raw materials. In principle, the development of new catalysts could greatly improve the effici…
First-principles structure search for the stable isomers of stoichiometric WS2 nano-clusters
Roohollah Hafizi, S. Javad Hashemifar, Mojtaba Alaei +2
In this paper, we employ evolutionary algorithm along with the full-potential density functional theory (DFT) computations to perform a comprehensive search for the stable structur…