Methods and Software Legion: A New Platform for Gaussian Wavepacket Dynamics A new software for multiple spawning in the Newton-X framework. (more…)By Mario Barbatti, 3 months ago
Methods and Software QDCT: A New Strategy for Nonadiabatic Molecular Dynamics QDCT seamlessly enhances surface hopping accuracy without adding computational cost. (more…)By Mario Barbatti, 8 monthsSeptember 5, 2024 ago
