A. Keromnes; W. K. Metcalfe; K. Heufer; H. J. Curran; N. Donohoe; A. K. Das; C. J. Sung; J. Herzler; C. Naumann; P. Griebel; O. Mathieu; M. C. Krejci; E. Petersen; W. J. Pitz; H. J. Curran, Combustion and Flame 2012, submitted, H2/CO = 5/95, Phi = 0.5, 8 bar series
Abstract The interface for VENUS and NWChem, and the resulting software package for direct dynamics simulations are described. The coupling of the two codes is considered to be a tight coupling since