Surface hopping

Improvement of the internal consistency in trajectory surface hopping

32. J.-Y. Fang and S. Hammes-Schiffer, “Improvement of the internal consistency in trajectory surface hopping,” J. Phys. Chem. A 103, 9399-9407 (1999).

Comparison of surface hopping and mean field approaches for model proton transfer reactions

29. J.-Y. Fang and S. Hammes-Schiffer, “Comparison of surface hopping and mean field approaches for model proton transfer reactions,” J. Chem. Phys. 110, 11166-11175 (1999).

Surface hopping and fully quantum dynamical wavepacket propagation on multiple coupled adiabatic potential surfaces for proton transfer reactions

14. J. Morelli and S. Hammes-Schiffer, “Surface hopping and fully quantum dynamical wavepacket propagation on multiple coupled adiabatic potential surfaces for proton transfer reactions,” Chem. Phys. Lett. 269, 161-170 (1997).