Index

Core dictionary version 3.0.14

_atom_type.number_in_cell

Definition:

   
     Total number of atoms of this atom type in the unit cell.

Type: Real

Units: none

Evaluation method:

    With t as atom_type
 
    cnt =  0.
 
    Loop a  as  atom_site  {
 
       if ( a.type_symbol == t.symbol ) {
 
          cnt +=  a.occupancy * a.site_symmetry_multiplicity
    }  }
    _atom_type.number_in_cell =  cnt

Category:
atom_type