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Developments in stochastic coupled cluster theory: The initiator approximation and application to the uniform electron gas

The Journal of chemical physics, 2016-02, Vol.144 (8), p.084108-084108

2016

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The HANDE-QMC Project: Open-Source Stochastic Quantum Chemistry from the Ground State Up

Journal of chemical theory and computation, 2019-03, Vol.15 (3), p.1728-1742

2019

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Reaching Full Correlation through Nonorthogonal Configuration Interaction: A Second-Order Perturbative Approach

Journal of chemical theory and computation, 2020-09, Vol.16 (9), p.5586-5600

2020

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Preconditioning and Perturbative Estimators in Full Configuration Interaction Quantum Monte Carlo

Journal of chemical theory and computation, 2019-06, Vol.15 (6), p.3537-3551

2019

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Accelerating Convergence in Fock Space Quantum Monte Carlo Methods

Journal of chemical theory and computation, 2020-03, Vol.16 (3), p.1503-1510

2020

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Holomorphic Hartree–Fock Theory: An Inherently Multireference Approach

Journal of chemical theory and computation, 2016-01, Vol.12 (1), p.167-173

2016

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Fermion Monte Carlo without fixed nodes: A game of life, death,and annihilation in Slater determinant space

The Journal of chemical physics, 2009-08, Vol.131 (5), p.054106-054106-10

2009

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Parity-Time Symmetry in Hartree–Fock Theory

Journal of chemical theory and computation, 2019-08, Vol.15 (8), p.4374-4385

2019

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Corrected density functional theory and the random phase approximation: Improved accuracy at little extra cost

The Journal of chemical physics, 2023-11, Vol.159 (17)

2023

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A stochastic approach to unitary coupled cluster

The Journal of chemical physics, 2020-12, Vol.153 (21), p.214106-214106

2020

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A study of the dense uniform electron gas with high orders of coupled cluster

The Journal of chemical physics, 2017-11, Vol.147 (19), p.194105-194105

2017

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Exciting Determinants in Quantum Monte Carlo: Loading the Dice with Fast, Low-Memory Weights

Journal of chemical theory and computation, 2019-01, Vol.15 (1), p.127-140

2019

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Localized Spin Rotations: A Size-Consistent Approach to Nonorthogonal Configuration Interaction

Journal of chemical theory and computation, 2022-02, Vol.18 (2), p.710-722

2022

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Using SCF metadynamics to extend density matrix embedding theory to excited states

The Journal of chemical physics, 2019-07, Vol.151 (3), p.034112-034112

2019

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A hybrid stochastic configuration interaction–coupled cluster approach for multireference systems

The Journal of chemical physics, 2023-05, Vol.158 (18)

2023

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Stochastic coupled cluster theory: Efficient sampling of the coupled cluster expansion

The Journal of chemical physics, 2017-09, Vol.147 (12), p.124105-124105

2017

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Erratum: “A stochastic approach to unitary coupled cluster” [J. Chem. Phys. 153, 214106 (2020)]

The Journal of chemical physics, 2022-06, Vol.156 (22), p.229902-229902

2022

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Symmetry in Multiple Self-Consistent-Field Solutions of Transition-Metal Complexes

Journal of chemical theory and computation, 2020-02, Vol.16 (2), p.904-930

2020

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General Approach for Multireference Ground and Excited States Using Nonorthogonal Configuration Interaction

Journal of chemical theory and computation, 2019-09, Vol.15 (9), p.4851-4861

2019

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Diagrammatic Coupled Cluster Monte Carlo

The journal of physical chemistry letters, 2019-03, Vol.10 (5), p.925-935

2019

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Theory and implementation of a novel stochastic approach to coupled cluster

The Journal of chemical physics, 2020-10, Vol.153 (14), p.144117-144117

2020

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Complex adiabatic connection: A hidden non-Hermitian path from ground to excited states

The Journal of chemical physics, 2019-01, Vol.150 (4), p.041103-041103

2019

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Modeling Electron Transfers Using Quasidiabatic Hartree–Fock States

Journal of chemical theory and computation, 2018-09, Vol.14 (9), p.4629-4639

2018

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Holomorphic Hartree–Fock Theory: The Nature of Two-Electron Problems

Journal of chemical theory and computation, 2018-02, Vol.14 (2), p.607-618

2018

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Multireference Stochastic Coupled Cluster

Journal of chemical theory and computation, 2019-12, Vol.15 (12), p.6625-6635

2019

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Developments in stochastic coupled cluster theory: The initiator approximation and application to the uniform electron gas

The HANDE-QMC Project: Open-Source Stochastic Quantum Chemistry from the Ground State Up

Reaching Full Correlation through Nonorthogonal Configuration Interaction: A Second-Order Perturbative Approach

Preconditioning and Perturbative Estimators in Full Configuration Interaction Quantum Monte Carlo

Accelerating Convergence in Fock Space Quantum Monte Carlo Methods

Holomorphic Hartree–Fock Theory: An Inherently Multireference Approach

Fermion Monte Carlo without fixed nodes: A game of life, death,and annihilation in Slater determinant space

Parity-Time Symmetry in Hartree–Fock Theory

Corrected density functional theory and the random phase approximation: Improved accuracy at little extra cost

A stochastic approach to unitary coupled cluster

A study of the dense uniform electron gas with high orders of coupled cluster

Exciting Determinants in Quantum Monte Carlo: Loading the Dice with Fast, Low-Memory Weights

Localized Spin Rotations: A Size-Consistent Approach to Nonorthogonal Configuration Interaction

Using SCF metadynamics to extend density matrix embedding theory to excited states

A hybrid stochastic configuration interaction–coupled cluster approach for multireference systems

Stochastic coupled cluster theory: Efficient sampling of the coupled cluster expansion

Erratum: “A stochastic approach to unitary coupled cluster” [J. Chem. Phys. 153, 214106 (2020)]

Symmetry in Multiple Self-Consistent-Field Solutions of Transition-Metal Complexes

General Approach for Multireference Ground and Excited States Using Nonorthogonal Configuration Interaction

Diagrammatic Coupled Cluster Monte Carlo

Theory and implementation of a novel stochastic approach to coupled cluster

Complex adiabatic connection: A hidden non-Hermitian path from ground to excited states

Modeling Electron Transfers Using Quasidiabatic Hartree–Fock States

Holomorphic Hartree–Fock Theory: The Nature of Two-Electron Problems

Multireference Stochastic Coupled Cluster

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