lammps

History

Axel Kohlmeyer 7193fffe0d make example input / output conform with LAMMPS conventions (no dump files, no log command) and update reference outputs		2017-07-06 16:08:25 -04:00
..
Data_region	some edits to make examples more illustrative.	2017-07-06 15:35:06 +09:00
Data_wall	adjust EES wall input example to print out some thermodynamic info that can be used for testing	2017-07-05 13:54:56 -04:00
README	some edits to make examples more illustrative.	2017-07-06 15:35:06 +09:00
in.fix_wall	make example input / output conform with LAMMPS conventions (no dump files, no log command) and update reference outputs	2017-07-06 16:08:25 -04:00
in.fix_wall_region	make example input / output conform with LAMMPS conventions (no dump files, no log command) and update reference outputs	2017-07-06 16:08:25 -04:00
log.23Jun17.fix_wall.g++.1	make example input / output conform with LAMMPS conventions (no dump files, no log command) and update reference outputs	2017-07-06 16:08:25 -04:00
log.23Jun17.fix_wall.g++.4	make example input / output conform with LAMMPS conventions (no dump files, no log command) and update reference outputs	2017-07-06 16:08:25 -04:00
log.23Jun17.fix_wall_region.g++.1	make example input / output conform with LAMMPS conventions (no dump files, no log command) and update reference outputs	2017-07-06 16:08:25 -04:00
log.23Jun17.fix_wall_region.g++.4	make example input / output conform with LAMMPS conventions (no dump files, no log command) and update reference outputs	2017-07-06 16:08:25 -04:00

README

Here one may find simple examples showing how "fix wall/ess" and "fix wall/region/ess" work. 


--in.fix_wall_region:
	
	This input uses "Data_region" to setup a system of three particles colliding with a
	cubic region which its walls interact with particle with EES potential. To find out details
	of how to set parameters of "fix wall/region/ees" see documentaion. 

--in.fix_wall
	
	This input uses "Data_wall" to confine a ellipsoidal particle between two EES walls.
	For more details lookup LAMMPS's documentation under "fix wall/ess" command.