sharc

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SHARC Program Suite

Copyright (c) 2023 University of Vienna


This file is part of SHARC.

SHARC is free software: you can redistribute it and/or modify
it under the terms of the GNU General Public License as published by
the Free Software Foundation, either version 3 of the License, or
(at your option) any later version.

SHARC is distributed in the hope that it will be useful,
but WITHOUT ANY WARRANTY; without even the implied warranty of
MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE.  See the
GNU General Public License for more details.

You should have received a copy of the GNU General Public License
along with SHARC.  If not, see <http://www.gnu.org/licenses/>.

Welcome to the SHARC Program Suite

Please refer to the following files for further information:

• AUTHORS: a list of the SHARC developers and contributors
• COPYRIGHT: the license under which SHARC can be used
• INSTALL: how to compile and install the program
• README: this file

directory structure:

• source: the (Fortran90) source files
• bin: the compiled executables as well as the Python scripts
• doc: the documentation (manual and tutorial)
• tests: a test suite to check the installation.
• examples: documented example inputs for quantum chemistry interfaces
• pysharc: source code for the PySHARC extension of SHARC
• lib: Python libraries for some SHARC components
• wfoverlap: wave function overlap program (with source/ and scripts/ directories)

-- for further information take a look at: http://www.sharc-md.org