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| No. | Article |
|---|---|
| 1 |
Comparisons between density functional theory and conventional ab initio methods for 1,2-elimination of HF from 1,1,1-trifluoroethane: Test case study for HF elimination from fluoroalkanes Martell JM, Beaton PT, Holmes BE Journal of Physical Chemistry A, 106(36), 8471, 2002 |