The Voth Group

Publications

Author Title [ Type

] Year

Filters: Author is Rega, N. [Clear All Filters]

Journal Article

Rega N, Iyengar SS, Voth GA, Schlegel HB, Vreven T, Frisch MJ. Hybrid Ab Initio Empirical Molecular Dynamics: Combining the ONIOM Scheme with the Atom-centered Density Matrix Propagation (ADMP) Approach. J. Phys. Chem. B. 2004 ;108:4210 - 4220.

DOI