Dear Ana,
this is described in Fischer, R. X. & Tillmanns, E. (1988): "The
equivalent isotropic displacement factor". Acta Crystallographica
Section C-Crystal Structure Communications 44, 775-776.
Best regards,
Johannes
Ana Isabel Becerro Nieto schrieb:
Dear All,
How can I convert the “anisotropic temperature factors” (u_ij ) into
an “isotropic temperature factor” (U_iso )?
Thank you!
ana
Dr. Ana Isabel Becerro
Instituto de Ciencia de Materiales de Sevilla -
Dpto. Química Inorgánica (CSIC-US)
C/ Américo Vespucio, 49
41092 Sevilla
Tel: 954489545
--
Johannes Birkenstock
Univ. Bremen
FB5-Kristallographie, ZEKAM
GEO, R2300
Klagenfurter Strasse
D-28359 Bremen
