Frank Rebentrost, William A. Lester Jr.
The Journal of Chemical Physics
A new H3 potential energy hypersurface for arbitrary nuclear arrangements is generated from Liu's very accurate (≈0.3 kcal/mole error) collinear ab initio calculation and compared with other general geometry surfaces. Preliminary classical trajectory calculations on the new hypersurface are presented and compared with results on the Porter-Karplus surface. © 1974.
Frank Rebentrost, William A. Lester Jr.
The Journal of Chemical Physics
Barbara J. Garrison, William A. Lester Jr., et al.
The Journal of Chemical Physics
William A. Lester Jr.
The Journal of Chemical Physics
Peter J. Reynolds, Michel Dupuis, et al.
The Journal of Chemical Physics