Overview
DFTB+ is fast and efficient stand-alone implementation of the Density Functional based Tight Binding (DFTB) method.
It was developed in Paderborn in the group of Professor Frauenheim and is the successor of the old DFTB and Dylax codes.
For more information, see the official DFTB+ site.
Users of the program are advised to sign up on the DFTB-Plus-User Maillist. Also, you may find answered questions of other DFTB+ users in the Mail list archive.
How to use
On Gadi platform NCI users have access to several versions of DFTB+, such as
- DFTB+, version 20.1 (Gadi)
- DFTB+, version 21.1 (Gadi)
- DFTB+, version 22.2 (Gadi)
- DFTB+, version 23.1 (Gadi)
- DFTB+, version 24.1 (Gadi)
Licence requirements
DFTB+ is free software licenced under the GNU Lesser General Public Licence.
Overview
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