README
6c8830b82800efficient_neuronet

README
View Options

			This package implements Drude oscillator methods for simulating
			polarizable systems in LAMMPS. The package provides the following
			features:

			* tagging particles as cores or Drude particles
			* thermostating the Drude oscillators at a distinct temperature
			using Langevin or Nosé-Hoover thermostats
			* computation of the atom and dipole temperatures
			* damping induced dipole interactions using Thole's function

			See the file doc/drude_tutorial.html for getting started.

			There are auxiliary tools for using this package in tools/drude.

			There are example scripts for using this package in examples/USER/drude.

			The person who created this package is Alain Dequidt at the
			Chemistry Institute of Clermont-Ferrand, Clermont University, France
			(alain.dequidt at univ-bpclermont.fr). Contact him directly if you
			have questions. Co-authors: Julien Devémy, Agilio Padua.