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README
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README
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(c) 2017, Thomas Frauenheim, Universität Bremen
All rights reserved
This work is licensed under the Creative Commons Attribution-ShareAlike 4.0
International License. To view a copy of this license, consult the LICENSE file
or visit http://creativecommons.org/licenses/by-sa/4.0/ .
NOTE: The rights holder(s) for this work explicitly require that the attribution
conditions of this license are enforced. Use in part or in whole of this data is
permitted only under the condition that the scientific background of the
Licensed Material will be CITED IN ANY PUBLICATIONS ARISING FROM ITS USE. The
required references are specified in this file and must be included in resulting works.
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].
Required references
-------------------
[JCTC12] J. Chem. Theory Comput., 2012, 8, pp 1153–1163.