xrd , ERROR: Unknown compute style (../modify.cpp:964)

Anil_Mangla · July 5, 2017, 4:16pm

Respected all,

I am facing the error as mentioned in the subject, for the compute command for xrd.

The input file and log file is attached.

I have installed user-diffraction package and then ‘make mpi’. It was successfully done.

Please help me , in fixing this error.

Thank fully

input (1.82 KB)

Stefan_Paquay · July 5, 2017, 4:45pm

Did you compile LAMMPS with the USER-DIFFRACTION package?

Stefan_Paquay · July 5, 2017, 4:48pm

Oops, that was too quick of me. Are you sure you are using the new executable after compiling in the package?