Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
5394320 | Computational and Theoretical Chemistry | 2013 | 6 Pages |
Abstract
⺠3-D inter-ring torsional potential for P3MT is calculated. ⺠The extent of the correlation between the torsional potentials is investigated. ⺠Second nearest rings interactions contribute 11% of the total potential variation. ⺠Extended interactions beyond the second nearest rings contribute less than 3%.
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Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Ram S. Bhatta, David S. Perry,