| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 5394409 | Computational and Theoretical Chemistry | 2013 | 10 Pages |
Abstract
⺠Phosphazenes containing trifluoro groups have been investigated computationally. ⺠Li binding has been modeled for all phosphazene structures. ⺠Depending on local environment, Li is 3 or 4 coordinate. ⺠Li binding energies decrease by 2.7 kcal/mol for every added CF3 group.
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Michael T. Benson, Mason K. Harrup, Kevin L. Gering,