next up previous contents index
Next: energy_data.coulomb_switch Coulomb Up: The energy_data class: objective Previous: energy_data.radii_factor scale   Contents   Index

energy_data.lennard_jones_switch -- Lennard-Jones switching parameters

Description:
These are the parameters $f_1$ and $f_2$ to the Lennard-Jones switching function, which smoothes the potential down to zero; see equation 6.63.



Ben Webb 2005-06-20