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Commit 67962b15 authored by Axel Kohlmeyer's avatar Axel Kohlmeyer
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a bunch refactoring changes in the python pair style and the examples

- make all python potential classes derived from LAMMPSPairPotential
  which contains shared functionality. We currently don't check
  for supported atom types. may want to add that again later.
- keep track of skipped atom types in the C++ code.
- add test against units setting. must set self.units='...' in constructor
- make compute_force method consistent with Pair::single() in LAMMPS and return force/r instead of force.
- rename potentials.py to py_pot.py
- update test runs. some small tweaks.
parent 1d48f287
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