(c) 2017, Thomas Frauenheim, Universität Bremen
All rights reserved

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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
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SVN repository information:
---------------------------
$Id: README 2555 2007-06-12 12:56:32Z niehaus $
$URL: svn+ssh://[email protected]/slako/tags/skful/hyb-0-2/README $


This special parameterization was used to investigate Sulfur
passivated GaAs surface reconstructions. It was also used to study
the adsorption of PTCDA on GaAs, Silver and Silicon surfaces.

The files have been updated to allow for TD-DFTB calculations.

 Relevant Publications
----------------------

- B. Szuecs, Z. Hajnal, T. Frauenheim, C. Gonzales, J. Ortega,
R. Perez, and F. Flores, Appl.Surf.Sci., vol. 212, p. 861, 2003.

- B. Szuecs, Z. Hajnal, R. Scholz, S. Sanna, and T. Frauenheim
Appl.Surf.Sci., vol. 234, pp. 173-177, 2004.


Required references
-------------------
None