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List of works by James J Shepherd

An optimized twist angle to find the twist-averaged correlation energy applied to the uniform electron gas

scientific article published on 01 May 2019

Fully Quantum Embedding with Density Functional Theory for Full Configuration Interaction Quantum Monte Carlo

scientific article published on 23 September 2019

Investigation of the full configuration interaction quantum Monte Carlo method using homogeneous electron gas models ⬇️

scientific article published on June 28, 2012

NECI: N-Electron Configuration Interaction with an emphasis on state-of-the-art stochastic methods

scientific article published on 01 July 2020

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

scientific article published on 15 April 2021

The Influence of Redox-Innocent Donor Groups in Tetradentate Ligands Derived from o-Phenylenediamine: Electronic Structure Investigations with Nickel

scientific article published on 06 September 2019

The Sign Problem in Density Matrix Quantum Monte Carlo

scientific article published on 21 September 2021

Using Density Matrix Quantum Monte Carlo for Calculating Exact-on-Average Energies for ab Initio Hamiltonians in a Finite Basis Set

scientific article published on 28 January 2020

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