activity
20042023
most citedNWChem: Past, Present, and Future

699 citations · 1.3k across the 39 of their papers we have counts for

collaborators

40 papers

quant-ph2023★ 2 cited

Quantum Simulation of Boson-Related Hamiltonians: Techniques, Effective Hamiltonian Construction, and Error Analysis

Bo Peng, Yuan Su, Daniel Claudino +3

A broad spectrum of physical systems in condensed-matter and high-energy physics, vibrational spectroscopy, and circuit and cavity QED necessitates the incorporation of bosonic deg…

quant-ph2023★ 1 cited

Impact of high-rank excitations on accuracy of the unitary coupled cluster downfolding formalism

Karol Kowalski, Bo Peng, Nicholas P. Bauman

In this paper, we evaluate the accuracy of the Hermitian form of the downfolding procedure utilizing the double unitary coupled cluster Ansatz (DUCC) on the H6 and H8 benchmark sys…

quant-ph2023

Quantum flow algorithms for simulating many-body systems on quantum computers

Karol Kowalski, Nicholas P. Bauman

We conducted quantum simulations of strongly correlated systems using the quantum flow (QFlow) approach, which enables sampling large sub-spaces of the Hilbert space through couple…

nucl-ex2023★ 5 cited

Quantum Information Science and Technology for Nuclear Physics. Input into U.S. Long-Range Planning, 2023

Douglas Beck, Joseph Carlson, Zohreh Davoudi +98

In preparation for the 2023 NSAC Long Range Plan (LRP), members of the Nuclear Science community gathered to discuss the current state of, and plans for further leveraging opportun…

quant-ph2023★ 1 cited

Coupled cluster downfolding techniques: a review of existing applications in classical and quantum computing for chemical systems

Nicholas P. Bauman, Bo Peng, Karol Kowalski

In this manuscript, we provide an overview of the recent developments of the coupled cluster (CC) downfolding methods, where the ground-state problem of a quantum system is represe…

physics.chem-ph2023

Real-time Equation-of-Motion Coupled-Cluster Cumulant Green's Function Method: Heterogeneous Parallel Implementation Based on the Tensor Algebra for Many-body Methods Infrastructure

Himadri Pathak, Ajay Panyala, Bo Peng +5

We report the implementation of the real-time equation-of-motion coupled-cluster (RT-EOM-CC) cumulant Green's function method [J. Chem. Phys. 152, 174113 (2020)] within the Tensor…