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List of works by Jeff Leiding

A generalized force-modified potential energy surface for mechanochemical simulations

scientific article published on 01 October 2015

An efficient approach to ab initio Monte Carlo simulation

scientific article published on 01 January 2014

Bonding and isomerism in SF(n-1)Cl (n = 1-6): a quantum chemical study

scientific article published on 17 December 2010

Bonding in SCln (n = 1-6): a quantum chemical study

scientific article published on 14 April 2011

First principles dynamics and minimum energy pathways for mechanochemical ring opening of cyclobutene

scientific article

Insights into the unusual barrierless reaction between two closed shell molecules, (CH3)2S + F2, and its H2S + F2 analogue: role of recoupled pair bonding

scientific article published on 17 May 2012

Optimization of Semiempirical Quantum Chemistry Methods via Multiobjective Genetic Algorithms: Accurate Photodynamics for Larger Molecules and Longer Time Scales

scientific article published on 4 June 2007

Reactive Monte Carlo sampling with an ab initio potential.

scientific article published in May 2016

Shockwave compression and dissociation of ammonia gas

scientific article published on 01 January 2019

The first row anomaly and recoupled pair bonding in the halides of the late p-block elements

scientific article published on 14 November 2012

Theoretical Studies of the Excited Doublet States of SF and SCl and Singlet States of SF2, SFCl, and SCl2 ⬇️

scientific article published on February 6, 2012

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