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List of works by Jeremy O. Richardson

A partially linearized spin-mapping approach for nonadiabatic dynamics. I. Derivation of the theory

scientific article published on 01 November 2020

A partially linearized spin-mapping approach for nonadiabatic dynamics. II. Analysis and comparison with related approaches

scientific article published on 01 November 2020

Ab initio instanton rate theory made efficient using Gaussian process regression

scientific article published on 01 December 2018

Calculations of quantum tunnelling rates for muonium reactions with methane, ethane and propane

scientific article published on 15 July 2020

Communication: nonadiabatic ring-polymer molecular dynamics.

scientific article published in July 2013

Concerted hydrogen-bond breaking by quantum tunneling in the water hexamer prism

scientific article

Derivation of instanton rate theory from first principles ⬇️

scientific article

Divide-and-Conquer Method for Instanton Rate Theory

scientific article published on 02 April 2019

Effects of tunnelling and asymmetry for system-bath models of electron transfer.

scientific article published in March 2018

Elucidating the Nuclear Quantum Dynamics of Intramolecular Double Hydrogen Transfer in Porphycene

scientific article published on 01 February 2019

Explaining the Efficiency of Photosynthesis: Quantum Uncertainty or Classical Vibrations?

scientific article published on 11 April 2022

Full- and reduced-dimensionality instanton calculations of the tunnelling splitting in the formic acid dimer.

scientific article published on 14 December 2016

Generalized spin mapping for quantum-classical dynamics

scientific article published on 01 February 2020

Improved population operators for multi-state nonadiabatic dynamics with the mixed quantum-classical mapping approach

scientific article published on 01 December 2019

Instanton calculations of tunneling splittings for water dimer and trimer.

scientific article published in September 2011

Instanton calculations of tunneling splittings in chiral molecules

scientific article published on 01 December 2020

Instanton formulation of Fermi's golden rule in the Marcus inverted regime

scientific article published on 01 January 2020

Instanton theory of tunneling in molecules with asymmetric isotopic substitutions

scientific article published on 01 September 2020

Investigation of terahertz vibration-rotation tunneling spectra for the water octamer

scientific article

Ion-mediated hydrogen-bond rearrangement through tunnelling in the iodide-dihydrate complex

scientific article published on 04 March 2019

Microcanonical Tunneling Rates from Density-of-States Instanton Theory

scientific article published on 22 December 2020

Microcanonical and thermal instanton rate theory for chemical reactions at all temperatures

scientific article

Non-oscillatory flux correlation functions for efficient nonadiabatic rate theory ⬇️

scientific article

Nonadiabatic quantum transition-state theory in the golden-rule limit. I. Theory and application to model systems

scientific article published on 01 March 2019

Nonadiabatic quantum transition-state theory in the golden-rule limit. II. Overcoming the pitfalls of the saddle-point and semiclassical approximations

scientific article published on 01 December 2019

On the identity of the identity operator in nonadiabatic linearized semiclassical dynamics

scientific article published on 01 February 2019

Perspective: Ring-polymer instanton theory

scientific article published on 01 May 2018

Publisher's Note: "Semiclassical analysis of the quantum instanton approximation" [J. Chem. Phys. 151, 144111 (2019)]

scientific article published on 01 November 2019

Quantum Tunneling Rates of Gas-Phase Reactions from On-the-Fly Instanton Calculations

scientific article published on 24 October 2016

Quantum dynamics of isolated molecules: general discussion

scientific article published on 01 December 2018

Quantum tunnelling pathways of the water pentamer

scientific article published on 20 December 2019

Revisiting nuclear tunnelling in the aqueous ferrous-ferric electron transfer

scientific article published on 24 February 2020

Ring-polymer instanton method for calculating tunneling splittings.

scientific article published in February 2011

Ring-polymer instanton theory of electron transfer in the nonadiabatic limit. ⬇️

scientific article

Ring-polymer molecular dynamics rate-theory in the deep-tunneling regime: Connection with semiclassical instanton theory.

scientific article published in December 2009

Semiclassical Green's functions and an instanton formulation of electron-transfer rates in the nonadiabatic limit. ⬇️

scientific article

Semiclassical analysis of the quantum instanton approximation

scientific article published on 01 October 2019

Semiclassical instanton formulation of Marcus-Levich-Jortner theory

scientific article published on 01 June 2020

Simultaneous Deep Tunneling and Classical Hopping for Hydrogen Diffusion on Metals

scientific article published on 19 September 2017

Spin-mapping approach for nonadiabatic molecular dynamics

scientific article published on 01 July 2019

Stress Test for Quantum Dynamics Approximations: Deep Tunneling in the Muonium Exchange Reaction D + HMu → DMu + H.

scientific article

Understanding Chemical Reactions beyond Transition-State Theory

scientific article published on 01 May 2018

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