Cleanup and bugfixes for some 3-body pair styles in the GPU package #2216
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Summary
The changes in this PR involve removing unused variables, some as addressed by #2197, more cleanup, and fixing bugs with building the short neighbor list in tersoff/gpu, tersoff/mod/gpu and tersoff/zbl/gpu that are triggered with multiple atom types.
Related Issues
The small but significant difference in the results between the GPU runs in double precision and the CPU-only run for tersoff/gpu with multiple atom types is first pointed out by @akohlmey when testing the changes in #2197.
Author(s)
Trung Nguyen (Northwestern)
Licensing
By submitting this pull request, I agree, that my contribution will be included in LAMMPS and redistributed under either the GNU General Public License version 2 (GPL v2) or the GNU Lesser General Public License version 2.1 (LGPL v2.1).
Backward Compatibility
Should maintain backward compability
Implementation Notes
The short neighbor lists are built with differently for the 3-body pair styles (tersoff/*, vashishta and sw).
Post Submission Checklist