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Module for computing energy, forces and virial with Brenner potential for hydrocarbons.
Ref. D. W. Brenner, Empirical potential for hydrocarbons for use in
simulating the chemical vapor deposition of diamond films.
Phys. Rev. B 42, 9458 (1990).
The IPModel_Brenner object reads parameters from a Brenner_params XML stanza.
gabor
2009-06-30