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Transition states and rearrangement mechanisms from hybrid eigenvector-following and density functional theory. Application to C10H10 and defect migration in crystalline silicon

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Bibliographic Details
Published in:	Chemical physics letters 2001-06, Vol.341 (1-2), p.185-194
Main Authors:	KUMEDA, Yuko, WALES, David J, MUNRO, Lindsey J
Format:	Article
Language:	English
Subjects:	Atomic and molecular physics Calculations and mathematical techniques in atomic and molecular physics (excluding electron correlation calculations) Condensed matter: structure, mechanical and thermal properties Density-functional theory Diffusion in solids Diffusion of impurities Electronic structure of atoms, molecules and their ions: theory Exact sciences and technology Physics Transport properties of condensed matter (nonelectronic)
Citations:	Items that cite this one
Online Access:	Get full text
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