Skip to main content

lj_potential_gpu

Function lj_potential_gpu 

Source
pub fn lj_potential_gpu(r: f32, params: &GpuMdParams) -> f32
Expand description

Lennard-Jones 12-6 pair potential.

Returns U(r) = 4ε [ (σ/r)¹² − (σ/r)⁶ ]. Returns zero for r >= cutoff.