Files
lammps/examples/PACKAGES/manifold/diffusion
2021-06-29 11:23:47 -04:00
..
2021-06-29 11:23:47 -04:00
2021-06-29 11:23:47 -04:00
2021-06-29 11:23:47 -04:00
2021-06-29 11:23:47 -04:00
2021-06-29 11:23:47 -04:00
2021-06-29 11:23:47 -04:00
2021-06-29 11:23:47 -04:00
2021-06-29 11:23:47 -04:00
2021-06-29 11:23:47 -04:00
2021-06-29 11:23:47 -04:00

This example uses fix nve/manifold/rattle and a Langevin thermostat to generate Brownian motion on a few manifolds. A plotting script is included to plot the mean squared displacement against theoretical expectation.