Phase behavior and local structure of a binary mixture in pores: Mean-field lattice model calculations for analyzing neutron scattering data

2005 ◽  
Vol 122 (12) ◽  
pp. 124510 ◽  
Author(s):  
Dirk Woywod ◽  
Sebastian Schemmel ◽  
Gernot Rother ◽  
Gerhard H. Findenegg ◽  
Martin Schoen
2002 ◽  
Vol 35 (4) ◽  
pp. 434-442 ◽  
Author(s):  
Markus Winterer ◽  
Robert Delaplane ◽  
Robert McGreevy

Extended X-ray absorption fine structure (EXAFS) and neutron scattering data from monoclinic zirconia are analysed independently and simultaneously by reverse Monte Carlo (RMC) modelling. X-ray and neutron powder diffraction data are analysed by Rietveld refinement. The results are compared with respect to the local structure around the zirconium cations. Monoclinic zirconia was chosen as a model system for the comparison of structural information obtained by EXAFS spectroscopy and scattering methods because it is crystalline but also has some local disorder. In the case of zirconia, analysis of EXAFS spectra by RMC modelling results in reliable and accurate information on the local structure, consistent with neutron scattering and diffraction experiments.


2016 ◽  
Vol 45 (10) ◽  
pp. 4380-4391 ◽  
Author(s):  
Helen D. Duncan ◽  
Martin T. Dove ◽  
David A. Keen ◽  
Anthony E. Phillips

Total neutron scattering data suggest new geometries for transient hydrogen bonding in a disordered metal–organic framework.


2005 ◽  
Vol 122 (24) ◽  
pp. 244718 ◽  
Author(s):  
Sebastian Schemmel ◽  
Gernot Rother ◽  
Helmut Eckerlebe ◽  
Gerhard H. Findenegg

2021 ◽  
Vol 155 (4) ◽  
pp. 044903
Author(s):  
Rodrigo Braz Teixeira ◽  
Daniel de las Heras ◽  
José Maria Tavares ◽  
Margarida M. Telo da Gama

1983 ◽  
Vol 27 (5) ◽  
pp. 1913-1926 ◽  
Author(s):  
C. H. Johnson ◽  
N. M. Larson ◽  
C. Mahaux ◽  
R. R. Winters

Langmuir ◽  
2002 ◽  
Vol 18 (2) ◽  
pp. 377-381 ◽  
Author(s):  
G. A. van Ewijk ◽  
G. J. Vroege

Langmuir ◽  
2003 ◽  
Vol 19 (10) ◽  
pp. 4483-4492 ◽  
Author(s):  
Nadezhda P. Shusharina ◽  
Sudhakar Balijepalli ◽  
Henri J. M. Gruenbauer ◽  
Paschalis Alexandridis

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