(git:e7e05ae)
molsym.F File Reference

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Modules

module  molsym
 Molecular symmetry routines.
 

Functions/Subroutines

subroutine, public molsym::release_molsym (sym)
 release an object of molsym type More...
 
subroutine, public molsym::molecular_symmetry (sym, eps_geo, coord, atype, weight)
 Main program for symmetry analysis. More...
 
subroutine, public molsym::print_symmetry (sym, coord, atype, element, z, weight, iw, plevel)
 Print the output of the symmetry analysis. More...