[DFTB-Plus-User] QUAZINANO2015 parameters
julien.ide.fr at gmail.com
Tue May 24 08:47:17 CEST 2016
Dear DFTB+ community,
I am currently doing some simulations on glasses.
Up to now I have use DFTB+ to calculate the band structure of SiO2 using
the pbc-0-3 parameterization.
Now I would like to work on glasses with a more complex composition.
I have found the QUASINANO2015 paper:
in which they have derived a new set of parameters for all the atoms I need.
Is anybody knows where I could find the skf files associated with this
They are not available on the DFTB website
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