Diffusion lammps (master) History

lammps/src/USER-DPD/npair_half_bin_newton_ssa.cpp
master3e89b270fdf842defffd1e9…

Mar 18 2017

USER-DPD: bugfix for npair_half_bin_newton_ssa when bonds are involved. Only…
0cd3f0cd63f2
·Tim Mattox on Mar 18 2017, 00:22.

Feb 22 2017

USER-DPD: fix typo in NPairHalfBinNewtonSSA::build(): sz1 instead of sx1…
19ffe5931529
·Tim Mattox on Feb 22 2017, 21:08.
USER-DPD: move centroid bin of stencil_ssa to the first slot. Eliminates a…
37810bdc5302
·Tim Mattox on Feb 22 2017, 21:08.
USER-DPD: change nstencil_ssa[] to eliminate a corner case Saves a conditional…
c2ee3285fc79
·Tim Mattox on Feb 22 2017, 21:08.
USER-DPD: Rework SSA to use a new neighbor list structure, ready for Kokkos…
4b3197202ba2
·Tim Mattox on Feb 22 2017, 21:08.
USER-DPD: Split the SSA stencil and neighbor list into subphases. NOTE: pair…
ee83b755eae4
·Tim Mattox on Feb 22 2017, 21:08.
USER-DPD: renumber AIRs back to 1-7 for ghosts, and just 0 for locals. This…
ce2da5068b6e
·Tim Mattox on Feb 22 2017, 21:08.
USER-DPD: remove unneeded gairct_ssa[] & anum vars, and some > 0 guards
3dddeef365cf
·Tim Mattox on Feb 22 2017, 21:08.
USER-DPD: properly compute AIRct_ssa values, and use them in fix_shardlow.
fb279a87f5ea
·Tim Mattox on Feb 22 2017, 21:08.
USER-DPD: Correct an error message typo.
e9d46f4e7acb
·Tim Mattox on Feb 22 2017, 21:08.
USER-DPD: track & use the extent of the local atoms in the bins
e42678ed517d
·Tim Mattox on Feb 22 2017, 21:08.
USER-DPD: new neighbor list code for SSA that gives neighbors to ghosts. This…
0512e7886067
·Tim Mattox on Feb 22 2017, 21:08.

Jan 17 2017

USER-DPD: bugfix for a segfault when using MOLECULE and DPD together.
01609f55e2b3
·Tim Mattox on Jan 17 2017, 18:47.

Dec 20 2016

USER-DPD: more whitespace fixes
c4e02a5d2b60
·Tim Mattox on Dec 20 2016, 17:17.

Sep 9 2016

USER-DPD: move nstencil_ssa out of core LAMMPS into USER-DPD
81fcbcd99cd0
·Tim Mattox on Sep 9 2016, 18:19.
USER-DPD: move custom binning stuff to a NBinSSA child class. Removes most SSA…
8ed3f4226e5b
·Tim Mattox on Sep 9 2016, 18:19.

Sep 7 2016

new neighbor list changes
c9c2ae6c6134
·Steve Plimpton on Sep 7 2016, 21:42.