Fix Reax Bonds/Species for Kokkos ReaxFF

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1

Hi Stan,

I have attached the snapshots of the error I faced while building kokkos. These are the steps I followed:

Used the latest development version of LAMMPS and a c++11 compiler
make yes-kokkos
make -j4 kokkos_mpi_only

Am I missing something here? Have anybody else come up with these errors?

Swastik

kokkoserr1.jpeg

kokkoserrcont.jpeg

kokkoserrcont1.jpeg

2

Hi Stan,

I have attached the snapshots of the error I faced while building kokkos.
These are the steps I followed:

Used the latest development version of LAMMPS and a c++11 compiler
make yes-kokkos
make -j4 kokkos_mpi_only

Am I missing something here? Have anybody else come up with these errors?

which version of LAMMPS is this? please always include this
information when reporting problems!
have you tried the latest version?
this compilation error was due to a contradicting changes to different
features of LAMMPS that has since been resolved.

axel.

3

Swastik,

I agree with Axel, this was a bug that is definitely fixed in the latest version of the LAMMPS.

Stan

4

Thanks a lot for the feedback… I downloaded and tried to compile Nov 4 2016 (stable version). I followed the same steps:
Used a c++11 compiler
make yes-kokkos
make -j4 kokkos_mpi_only

I am getting this error, has anybody got this error?

Thanks a lot…

Swastik

kokkoserrcont2.jpeg

5

The KOKKOS/Install.sh was not complete – it is fixed in 9Nov16 version (latest development version).

Ray