group scheme always uses generic non-bonded kernel - Redmine #2399
The cutoff-modifiers were not copied from interaction_const_t to forcerec_t, which is only used by the group scheme. This causes the generic kernel to be chosen instead of SIMD or the plain-C kernel. It seems this only affects performance and not correctness.
(from redmine: issue id 2399, created on 2018-02-05 by berkhess, closed on 2018-02-06)
- Changesets:
- Revision c54cf431 by Berk Hess on 2018-02-05T15:05:23Z:
Set cutoff modifiers in forcerec
The cutoff modifiers were not copied from interaction_const_t
to forcerec_t which meant only the generic kernels was used with
the group scheme.
Fixes #2399
Change-Id: I2890cbd55e648e434ad3817edc4e5fe4c5697162