Parameter set "borg-0-1"

The set is intended as addition to the mio-set for organic molecules.The parameterization was done on molecular reference systems but seems to work also for boron systems with periodic boundary conditions [JCTC12].

Relevant publications

[JCTC12] J. Chem. Theory Comput. 8, 1153-1163 (2012)

Publications to be cited

B-* [JCTC12]

Required sets


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