Homec4science

Fixed errors in FixRxKokkos kokkos neighbor lists initialization and usage and…

Description

Fixed errors in FixRxKokkos kokkos neighbor lists initialization and usage and calls to computeLocalTemperature.

  • Created request for kokkos neighbor list for fix and switched to that neighbor list datatype in computeLocalTemperature.
  • Reconfigured pre_force and setup_pre_force to call a common solve_reactions() method to avoid duplicate code.

TODO:

  • Clean-up
  • Provide per-problem scratch data within kokkos framework (instead of C++ new/delete data).

Details

Committed
Christopher Stone <chris.stone@computational-science.com>Feb 13 2017, 22:33
Pushed
jungeOct 19 2017, 09:53
Parents
rLAMMPS0d57a1d831e6: Added setup_pre_force, pack/unpack methods to FixRxKokkos.
Branches
Unknown
Tags
Unknown

Event Timeline

Christopher Stone <chris.stone@computational-science.com> committed rLAMMPSf2d005fb8db0: Fixed errors in FixRxKokkos kokkos neighbor lists initialization and usage and… (authored by Christopher Stone <chris.stone@computational-science.com>).Feb 13 2017, 22:33