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https://github.com/triqs/dft_tools
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8dc42b08ae
* restructuring * added user reference * started working on user guide * added schematic to structure
21 lines
513 B
ReStructuredText
21 lines
513 B
ReStructuredText
.. index:: DFT Tools
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.. module:: pytriqs.applications.dft
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.. _dfttools:
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DFT Tools
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=========
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This application is aimed at DMFT calculations with
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realistic band structure calculations.
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A priori TRIQS can be connected to various realistic band structure codes.
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In this release, we provide the dft_tools extension module which contains an
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interface to the
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* `WIEN2K package <http://www.wien2k.at>`_.
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* A general Hamiltonian H(k)
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* FLEUR (in progress..)
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* VASP? (in progress..)
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* Wannier90? (in progress..)
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