M. Dupuis, J. Pacansky
The Journal of Chemical Physics
Extensive SCF calculations are reported for the structures of cubane, cubene, and the cubyl radical. An estimate is provided for the energy required for scission of a C-H bond in cubane and a β C-H bond in the cubyl radical. The energetics of both of these reactions are used to understand the geometry of the cubyl radical. © 1981 American Chemical Society.
M. Dupuis, J. Pacansky
The Journal of Chemical Physics
J. Pacansky, R.J. Waltman, et al.
Symposium on Molecular Modeling of Petroleum Processes and Catalysis 1992
R.J. Waltman, J. Pacansky, et al.
Chemistry of Materials
J. Pacansky, R.J. Waltman, et al.
Journal of radiation curing