:mod:`nvalchemiops.interactions`: Lennard-Jones =============================================== .. currentmodule:: nvalchemiops.interactions Warp launchers for the Lennard-Jones pair potential. Each launcher accepts a neighbor matrix or a CSR neighbor list. A nonzero ``switch_width`` applies the C2 switching function below over the last ``switch_width`` of the cutoff. .. autofunction:: lj_energy .. autofunction:: lj_forces .. autofunction:: lj_energy_forces .. autofunction:: lj_energy_forces_virial Switching Function ------------------ .. autofunction:: switch_c2