Molecular Dynamics 3 Timestep must be small enough to accurately sample highest frequency motion. Typical timestep is 1 fs (1 x 10-15 s)
{"Image DocumentName": "Molecular Dynamics 3Timestep must be small enough to accurately sample highest frequency motion. Typical timestep is 1 fs (1 x s)", "Image ImageDescription": "Typical simulation length = ps. Is this timescale relevant to your process? Simulation has two parts: - equilibration (redistribute energy) - production (record data) Results: - diffusion coefficients - free energies / phase transformations (very hard!) Is your result statistically significant?", "Image XResolution": "37", "Image YResolution": "37", "Image ResolutionUnit": "Pixels/Centimeter", "Image Software": "SlidePlayer", "Image YCbCrPositioning": "Centered"}