pele.utils.neighbor_list.NeighborListPotentialMulti.getHessian

NeighborListPotentialMulti.getHessian(coords)[source]

return the hessian

Previous topic

pele.utils.neighbor_list.NeighborListPotentialMulti.getGradient

Next topic

pele.utils.neighbor_list.NeighborListPotentialMulti.needNewList