Commit b96100c0 authored by mkanski's avatar mkanski
Browse files

Fixed header for the force field file

parent 26900754

potentials/ffield.ci-reax.CH

+1 −1
Original line number Diff line number Diff line 
DATE: 2017-03-20 CONTRIBUTOR: Michal Kanski

DATE: 2017-11-20 CONTRIBUTOR: Michal Kanski Development of a Charge-Implicit ReaxFF Potential for Hydrocarbon Systems DOI: 10.1021/acs.jpclett.7b03155

 39       ! Number of general parameters                                        

   50.0000 !p(boc1)                                                             

    9.5469 !p(boc2)

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