Classification and use of electron density data

International Tables for Crystallography (2006). Vol. G. ch. 3.5, pp. 141-143
https://doi.org/10.1107/97809553602060000737

Chapter 3.5. Classification and use of electron density data

area detectors 3.5.1

ATOM_LOCAL_AXES 3.5.3, 3.5.3.1, 3.5.3.1

_atom_local_axes_atom_label 3.5.3.1

ATOM_RHO_MULTIPOLE 3.5.3, 3.5.3.2

_atom_rho_multipole_atom_label 3.5.3.2

_atom_rho_multipole_coeff_Pv 3.5.3.2

_atom_rho_multipole_kappa 3.5.3.2

_atom_rho_multipole_scat_core 3.5.3.2

_atom_rho_multipole_scat_valence 3.5.3.2

_atom_site_label 3.5.3.1, 3.5.3.2

axes

atom-centred electron density 3.5.3, 3.5.3.1

chemical bonding 3.5.1

CIFtbx 3.5.4

Commission on Charge, Spin and Momentum Densities 3.5.1

computer programs

CIFtbx 3.5.4

density functional theory 3.5.1

dictionary

composite 3.5.3

rhoCIF 3.5.1

electron density 3.5.1

multipole expansion model 3.5.2, 3.5.3.1, 3.5.3.2

precision electron density studies 3.5.1

protocols

dictionary merging 3.5.3

rhoCIF

classification and use 3.5.1

design considerations 3.5.2

topology, electron density 3.5.1