Research data supporting "Dynamic Diastereomerism on Chiral Surfaces"
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Description
Molecular dynamics output files of S-alanine and R-alanine desorbing from Cu{531} or Cu{110} (indicated in the filename). Trajectories were calculated with CASTEP V.18.1
Version
Software / Usage instructions
CASTEP V.18.1 (proprietary)
Keywords
Adsorption, Chirality, Molecular dynamics, Surface Science
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Sponsorship
EPSRC (2112388)
UKRI grant number 2112388