Tunneling splittings in the energetically low-lying structural isomers of the water hexamer: the prism, the cage and the book

Advantages and Limitations of Landau-Zener Surface Hopping Dynamics

Quantum tunneling in the water hexamer prism

Quantum tunneling in the low-lying water hexamer isomers

Tunneling Splittings in Vibrationally Excited States of the Water Hexamer Prism

Tunneling Splittings in Vibrationally Excited States of the Water Hexamer Prism

Vibrational tunneling spectra of the water hexamer prism

Vibrational tunneling spectra of the water hexamer prism

What Can We Learn by Comparing Surface Hopping Algorithms?

What Can We Learn by Comparing Surface Hopping Algorithms?

Usporedba algoritama za preskakanje ploha u neadijabatskoj molekularnoj dinamici

Sigmatropno pregrađivanje