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api/mm/H01-Jul-2019-1,329586

doc/H01-Jul-2019-13,76811,270

external/H01-Jul-2019-192,261170,682

prog/H01-Jul-2019-99,22558,223

sys/H01-Jul-2019-640462

test/H01-Jul-2019-770,622763,590

tools/H01-Jul-2019-2,8812,097

utils/H03-May-2022-1,6601,123

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AUTHORS.rstH A D01-Jul-20191.2 KiB4928

CHANGELOG.rstH A D01-Jul-20193.1 KiB17091

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COPYINGH A D01-Jul-201934.3 KiB675553

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INSTALL.rstH A D01-Jul-20195.7 KiB167108

LICENSEH A D01-Jul-20191.9 KiB3329

README.rstH A D01-Jul-2019935 2014

make.archH A D03-May-20224.4 KiB173123

make.configH A D03-May-20223.3 KiB9369

makefileH A D03-May-20227.8 KiB255168

README.rst

1*****************************************************************
2DFTB+: general package for performing fast atomistic calculations
3*****************************************************************
4
5DFTB+ is a software package for carrying out fast quantum mechanical atomistic
6calculations based on the Density Functional Tight Binding method. It can be
7either used as a standalone program or integrated into other software packages
8as a library.
9
10The project is hosted on `github <http://github.com/dftbplus/dftbplus>`_.
11
12DFTB+ is released under the GNU Lesser General Public License. Please consult
13the included `LICENSE <LICENSE>`_ file for the detailed licensing conditions.
14
15Information on the compiling, testing and installation of DFTB+ is given in the
16file `INSTALL.rst <INSTALL.rst>`_ in this directory.
17
18If you wish to contribute to the project, please check the `CONTRIBUTING.rst
19<CONTRIBUTING.rst>`_ file for guide lines.
20