BK water models

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BK water models (Baranyai-Kiss) is a polarizable charge-on-spring model of water with three Gaussian charges.

BKd1

[1]

BKd2

[2]

BKd3

[3]

BK3

[4]

References

  1. ↑ Péter Kiss, Mária Darvas, András Baranyai, and Pál Jedlovszky "Surface properties of the polarizable Baranyai-Kiss water model", Journal of Chemical Physics 136 114706 (2012)
  2. ↑ András Baranyai and Péter T. Kiss "Polarizable model of water with field-dependent polarization", Journal of Chemical Physics 135 234110 (2011)
  3. ↑ Péter T. Kiss and András Baranyai "Density maximum and polarizable models of water", Journal of Chemical Physics 137 084506 (2012)
  4. ↑ Péter T. Kiss and András Baranyai "A systematic development of a polarizable potential of water", Journal of Chemical Physics 138 204507 (2013)
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