			This package implements 3 commands which can be used in a LAMMPS input
			script:

			pair_style lj/sdk
			pair_style lj/sdk/coul/long
			angle_style sdk

			These styles allow coarse grained MD simulations with the
			parametrization of Shinoda, DeVane, Klein, Mol Sim, 33, 27 (2007)
			(SDK), with extensions to simulate ionic liquids, electrolytes,
			lipids and charged amino acids.

			See the doc pages for these commands for details.

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

			This is the second generation implementation reducing the the clutter
			of the previous version. For many systems with long range
			electrostatics, it will be faster to use pair_style hybrid/overlay
			with lj/sdk and coul/long instead of the combined lj/sdk/coul/long
			style, since the number of charged atom types is usually small.
			To exploit this property, the use of the kspace_style pppm/cg is
			recommended over regular pppm.

			The person who created this package is Axel Kohlmeyer at Temple U
			(akohlmey at gmail.com). Contact him directly if you have questions.

			---------------------------------

			Thanks for contributions, support and testing goes to

			Wataru Shinoda (Nagoya University)
			Russell DeVane (Procter & Gamble)
			Michael L. Klein (Temple University, Philadelphia)
			Balasubramanian Sundaram (JNCASR, Bangalore)

			version: 1.0 / 2017-04-26

lammps/src/USER-CGSDK/README
f5cf1f1314b0master

README
View Options