검색결과 : 2건
| No. | Article |
|---|---|
| 1 |
Optimizing the structures of minimum and transition state on the free energy surface Yang SY, Hristov I, Fleurat-Lessard P, Ziegler T Journal of Physical Chemistry A, 109(1), 197, 2005 |
| 2 |
Free energy profiles for the identity S(N)2 reactions Cl-+CH3Cl and NH3+H3BNH3: A constraint ab initio molecular dynamics study Yang SY, Fleurat-Lessard P, Hristov I, Ziegler T Journal of Physical Chemistry A, 108(43), 9461, 2004 |