Contents DFTB Manual
Table of Contents
Introduction
Input
.. Parameter files
.. Atomic coordinates
.. Net Charge
.. SCF
.. Runtype
Examples
References
.. DFTB: general description
.. DFTB: elements
Keywords
Keywords
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ATOMS
CHARGE
GEOMETRY
RESOURCESDIR
SCF
Table of Contents
DFTB Manual
Table of Contents
Introduction
Input
Parameter files
Atomic coordinates
Net Charge
SCF
Runtype
Examples
References
DFTB: general description
DFTB: elements
Dresden
DFTB.org
Keywords
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