TABLE OF CONTENTS
ABINIT/41_geometry [ Directories ]
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NAME
41_geometry
DESCRIPTION
This directory contains level-2 routines that are related to the treatment of the unit cell, the atomic positions inside the unit cell (reduced coordinates or cartesian coordinates), and the symmetry operations related to the cell and atoms. In particular, the symmetry recognition (symanal.F90, symspgr.F90), the Bravais lattice recognition (symbrav.F90), as well as the space group database (symgroup.F90) can be found here.
COPYRIGHT
Copyright (C) 1998-2024 ABINIT group (TD) This file is distributed under the terms of the GNU General Public License, see ~abinit/COPYING or http://www.gnu.org/copyleft/gpl.txt . For the initials of contributors, see ~abinit/doc/developers/contributors.txt .
CHILDREN
interfaces_41_geometry.F90 m_ab7_symmetry.F90 m_crystal.F90 m_ewald.F90 m_geometry.F90 m_spgbuilder.F90 m_spgdata.F90 m_supercell.F90 m_symfind.F90 m_symlist.F90 m_symsg.F90