[DFTB-Plus-User] chalcogenide parameter files
singh_gurinder78 at yahoo.co.in
Sat Jul 25 20:15:03 CEST 2009
I am trying to run DFTB Codes on chalcogenide glasses. But only system on which it could be made to run is As2S3 and As-S-H as only these parametric files are available. Any one working to include other parametric files so that code could be run on other chalcogenide glasses..
Dr Gurinder Singh
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