-Potential scoring inconsistencies reported from moments.py and lammps. This may also be linked to GA not selecting the lowest score structures.
Additionally,
-remove calls to gradient move inside of crossover
-add shuffle_ele function
-move gradient move (lammps local minimization) to same level as other mutation
-clean up comments & testing code in motion.py @jmgoff
-Potential scoring inconsistencies reported from moments.py and lammps. This may also be linked to GA not selecting the lowest score structures.
Additionally,
-remove calls to gradient move inside of crossover
-add shuffle_ele function
-move gradient move (lammps local minimization) to same level as other mutation
-clean up comments & testing code in motion.py @jmgoff