Core dictionary version 3.0.14
_atom_sites_Cartn_transform.vec_3
Name:_atom_sites_Cartn_transform.vec_3
Aliases:
_atom_sites_Cartn_tran_vector_3
_atom_sites.Cartn_transf_vector[3]
Definition:
Matrix used to transform fractional coordinates in the ATOM_SITE category to Cartesian coordinates. The axial alignments of this transformation are described in _atom_sites_Cartn_transform.axes. The 3x1 translation is defined in _atom_sites_Cartn_transform.vector. x' |11 12 13| x | 1 | ( y' )Cartesian = mat|21 22 23| * ( y )fractional + vec| 2 | z' |31 32 33| z | 3 | The default transformation matrix uses Rollet's axial assignments with cell vectors a,b,c aligned with orthogonal axes X,Y,Z so that c||Z and b in plane YZ.
Type: Real
Units: reciprocal_angstroms
Category:
atom_sites_Cartn_transform