NAME

       xtp_basisset - Part of the VOTCA package

SYNOPSIS

       xtp_basisset [OPTIONS]

       xtp_basisset [--help]

DESCRIPTION

       Creates votca xml basissetfiles from NWCHEM basissetfiles

OPTIONS

       options:

         -h, --help                                     show this help message and
                                                        exit
         -f INPUT, --input INPUT                        NWchem file containing the
                                                        basisset or Turbomole folder
                                                        with element names.
         -o OUTPUTFILE, --outputvotca OUTPUTFILE        Path of votca outputfile
         -t TURBOBASIS, --turbomolebasisset TURBOBASIS  For turbomole specify the
                                                        basisset that is supposed to
                                                        be extracted from Files, for
                                                        auxbasis sets the basisset
                                                        the aux basisset is supposed
                                                        to be used for.

AUTHORS

       Written and maintained by the VOTCA Development Team <devs@votca.org>

COPYRIGHT

       Copyright 2009-2024 The VOTCA Development Team (http://www.votca.org)

       Licensed under the Apache License, Version 2.0 (the "License"); you may not use this  file
       except in compliance with the License.  You may obtain a copy of the License at

              http://www.apache.org/licenses/LICENSE-2.0

       Unless  required by applicable law or agreed to in writing, software distributed under the
       License is distributed on an "AS IS" BASIS, WITHOUT WARRANTIES OR CONDITIONS OF ANY  KIND,
       either  express  or  implied.   See  the  License  for  the  specific  language  governing
       permissions and limitations under the License.