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Using Diffusion Monte Carlo to investigate molecules that undergo large amplitude vibrational motions
Overview talk on potential energy surfaces
Geometric integrators for the Schrödinger equation: Splitting and Magnus integrators
Fourier grid QM/MM simulations of the hydrated electron
Concluding discussion
Bohmian mechanics with complex action: An exact formulation of quantum mechanics with complex trajectories
Automatic construction of ab initio potential energy surfaces
A fast path integral method for liquid water