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Molecular Dynamics Simulation of the Glass Transition of Ortho-Terphenyl in Bulk and Thin Films

✍ Scribed by Ghosh, Jayeeta; Faller, Roland


Book ID
118123182
Publisher
Cambridge University Press
Year
2006
Weight
756 KB
Volume
924
Category
Article
ISSN
0272-9172

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Molecular dynamics simulation of organic
✍ Ou, Jane J.; Chen, Shaw H. πŸ“‚ Article πŸ“… 1998 πŸ› John Wiley and Sons 🌐 English βš– 225 KB

A computer code was prepared for the molecular dynamics MD simulation of a multimolecular system to atomic resolution. Based on a widely ãccepted force field and aided by simulated annealing of single molecules, V ãnd E were computed for ortho-terphenyl and 1,3,5-tri-␣-naphthyl benzene across an ext