James Shepherd

Iowa State University

United States

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Articles (10)

Year:

2023

Year:

2023

Year:

2023

Year:

2023

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2022

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2022

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2021

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2021

Year:

2021

Year:

2021

Collaborators (3)

Ned Bowden

Professor

Iowa State University

UNITED STATES

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Tobias Schäfer

Vienna University of Technology

AUSTRIA

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Florence J. Williams

Iowa State University

UNITED STATES

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James Shepherd

Research Interests

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Articles (10)

Polymerization of Primary Amines with Sulfur Monochloride to Yield Red Polymers with a Conjugated SN Backbone

Electronic Free Energy Surface of the Nitrogen Dimer Using First-Principles Finite Temperature Electronic Structure Methods

Electronic specific heat capacities and entropies from density matrix quantum Monte Carlo using Gaussian process regression to find gradients of noisy data

How the Exchange Energy Can Affect the Power Laws Used to Extrapolate the Coupled Cluster Correlation Energy to the Thermodynamic Limit

Machine learning for a finite size correction in periodic coupled cluster theory calculations

Piecewise interaction picture density matrix quantum Monte Carlo

A shortcut to the thermodynamic limit for quantum many-body calculations of metals

The Sign Problem in Density Matrix Quantum Monte Carlo

Iron‐Catalyzed Halogen Exchange of Trifluoromethyl Arenes**

Power Laws Used to Extrapolate the Coupled Cluster Correlation Energy to the Thermodynamic Limit

Collaborators (3)

Ned Bowden

Tobias Schäfer

Florence J. Williams

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