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Magnetic structures (magCIF) version 0.9.8
_atom_type_scat.neutron_magnetic_j0_A1
Name:_atom_type_scat.neutron_magnetic_j0_A1
Definition:
First, the parameters are used directly to approximate spatial averages of spherical Bessel functions over the electronic wave functions of unpaired electrons of the given atom type as a function of s = sin(theta)/lambda. <jn(s)> = [A1*e^(-a2*s^2) + B1*e^(-b2*s^2) + C1*e^(-c2*s^2) + D]*[1 if n=0, s^2 if n=2,4,6] The <jn(s)> are then combined to determine the spin and orbital contributions to the magnetic form factor of the atom. The "e" parameter is a measure of error in the approximation. Analogous tags: coreCIF:_atom_site.scat_Cromer_Mann_* Ref: International Tables for Crystallography (2006). Vol. C, Sections 4.4.5 and 6.1.2.3 (and references therein).
Type: Real
Category:
atom_type_scat