Merge pull request mir-group#334 from mir-group/mpifix

Add broadcast of kernel string length

restore pair_lj_cut

fix workflow

add wandb in requirements

Merge pull request mir-group#310 from mir-group/gemm

Kokkos multispecies acceleration with type-sorting and matrix-matrix products

run black

detect freeze_hyps

Update README.md

This version is before we remove mgp force mapping & add symmetry red…

…uction