Constraints in the MEM based on the measured intensities from powder-diffraction data
Magdysyuk, O.V.,
van Smaalen, S. and
Dinnebier, R.E.,
International Tables for Crystallography
(2019).
Vol. H,
Section 4.8.6,
p.
[ doi:10.1107/97809553602060000963 ]
on calculated structure factors,, of the prior structure model (Palatinus &
van Smaalen, 2005): where the symbols have the same meaning as in equations (4.8.10) and (4.8.28), but and is the number of reflections included in the PDC ...
Constraints using `partly phased' reflections for anomalous-scattering X-ray powder diffraction
Magdysyuk, O.V.,
van Smaalen, S. and
Dinnebier, R.E.,
International Tables for Crystallography
(2019).
Vol. H,
Section 4.8.6.2,
p.
[ doi:10.1107/97809553602060000963 ]
...
F and G constraints
Magdysyuk, O.V.,
van Smaalen, S. and
Dinnebier, R.E.,
International Tables for Crystallography
(2019).
Vol. H,
Section 4.8.6.1,
p.
[ doi:10.1107/97809553602060000963 ]
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van Smaalen, S. & Jansen, M. (2010). Maximum entropy method and charge flipping ...
Observed structure factors
Magdysyuk, O.V.,
van Smaalen, S. and
Dinnebier, R.E.,
International Tables for Crystallography
(2019).
Vol. H,
Section 4.8.6.4,
p.
[ doi:10.1107/97809553602060000963 ]
Schneider, M. &
van Smaalen, S. (1998). Disorder in the crystal structure of Cs 2 HgCl 4 studied by the maximum entropy method. Acta Cryst. B 54, 626–634. Google Scholar
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Prior-derived F constraints
Magdysyuk, O.V.,
van Smaalen, S. and
Dinnebier, R.E.,
International Tables for Crystallography
(2019).
Vol. H,
Section 4.8.6.3,
p.
[ doi:10.1107/97809553602060000963 ]
constraints (PDCs) based on calculated structure factors,, of the prior structure model (Palatinus &
van Smaalen, 2005): where the symbols have the same meaning as in equations (4.8.10) and (4.8.28), but and is the number ...
