James Shee

35PUBLICATIONS
61CO-AUTHORS
Theoretical quantum chemistryRadiation and matterTransport properties and non-equilibrium processesDegenerate quantum gases and atom opticsMetal cluster chemistry
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Publications (35)

|Aug 31, 2026
Selecting Optimal Unrestricted Hartree-Fock Trial Wave Functions for Phaseless Auxiliary-Field Quantum Monte Carlo: Accuracy and Limitations in Modeling Three Iron-Sulfur Clusters.

|Mar 03, 2026
Evaluating Multiconfigurational Trials for Accurate Phaseless Auxiliary-Field Quantum Monte Carlo on 3d Transition Metal Complexes.

Hung T Vuong, Ankit Mahajan, John L Weber

|Dec 16, 2025
Noncovalent Interaction Energies with Phaseless Auxiliary-Field Quantum Monte Carlo.

Devesh Awasthi, Leon Otis, Emily Huang

|Nov 03, 2025
Enhancing the Accuracy and Efficiency of Sample-Based Quantum Diagonalization with Phaseless Auxiliary-Field Quantum Monte Carlo.

Don Danilov, Javier Robledo-Moreno, Kevin J Sung

|Oct 24, 2025
A Scalable Route to First-Order Response Properties with Correlated Sampling Phaseless Auxiliary-Field Quantum Monte Carlo.

Leon Otis, Saisrinivas Gudivada, Marvin Friede

|Aug 11, 2025
Disentangling the Noncovalent Interactions That Drive Coinage Metal Cluster Dimerization.

Devesh Awasthi, Marvin Friede, Manasseh Kusi Osei

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Frequent Collaborators

11 joint publications

Martin Head-Gordon

8 joint publications

John L Weber

7 joint publications

Richard A Friesner

5 joint publications

Benjamin Rudshteyn