newton pair on

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1

Hi all,

I am trying to run lammps using gpu package and I am a beginner in using gpus. I am using tip4p water model along with eam potential for copper. I get the error of "Pair style lj/cut/tip4p/long requires newton pair on (…/pair_lj_cut_tip4p_long.cpp:457)
Cuda driver error 4 in call at file ‘geryon/nvd_device.h’ "

When I turn newton pair on, I get the error of “Cannot use newton pair with eam/gpu pair style”

I really appreciate it if you can help me overcome this problem.

Best regards,

2

Hi all,

I am trying to run lammps using gpu package and I am a beginner in using
gpus. I am using tip4p water model along with eam potential for copper. I
get the error of "Pair style lj/cut/tip4p/long requires newton pair on
(../pair_lj_cut_tip4p_long.cpp:457)
Cuda driver error 4 in call at file 'geryon/nvd_device.h' "

When I turn newton pair on, I get the error of "Cannot use newton pair
with eam/gpu pair style"

I really appreciate it if you can help me overcome this problem.

​don't use the GPU package. with running lj/cut/tip4p/long and the
neighborlist​ on the CPU, there is very little to gain from GPU
acceleration anyway.

axel.