검색결과 : 3건
No. | Article |
---|---|
1 |
Deprotonation of solvated formic acid: Car-Parrinello and metadynamics simulations Lee JG, Asciutto E, Babin V, Sagui C, Darden T, Roland C Journal of Physical Chemistry B, 110(5), 2325, 2006 |
2 |
Exploring intramolecular reactions in complex systems with metadynamics: The case of the malonate anions Asciutto E, Sagui C Journal of Physical Chemistry A, 109(34), 7682, 2005 |
3 |
Thermal and solvent effects on the coordination structure of LiA1H(4): a computational study Asciutto E, Crespo A, Estrin DA Chemical Physics Letters, 353(1-2), 178, 2002 |