scholarly journals The Molecular Basis for Properties of Binary Solvent Systems: Synchrotron X-ray Pair Distribution Function Analysis of the Acetone-Water System

Author(s):  
Anuradha Pallipurath ◽  
Bethan Evans ◽  
Arturs Pugejs ◽  
Philip A. Chater ◽  
Sven L.M. Schroeder

The acetone-water phase diagram. Dynamic structural insights into intermolecular interactions in acetone-water binary mixtures modelled from synchrotron total X-ray scattering describes phase behavior.<br> <br>

2020 ◽  
Author(s):  
Anuradha Pallipurath ◽  
Bethan Evans ◽  
Arturs Pugejs ◽  
Philip A. Chater ◽  
Sven L.M. Schroeder

The acetone-water phase diagram. Dynamic structural insights into intermolecular interactions in acetone-water binary mixtures modelled from synchrotron total X-ray scattering describes phase behavior.<br> <br>


2018 ◽  
Vol 124 (5) ◽  
pp. 56001 ◽  
Author(s):  
Rodrigo U. Ichikawa ◽  
João P. R. L. L. Parra ◽  
Oriol Vallcorba ◽  
Inma Peral ◽  
Walter K. Yoshito ◽  
...  

2007 ◽  
Vol 40 (1) ◽  
pp. 196-198 ◽  
Author(s):  
Karena W. Chapman ◽  
Peter J. Chupas ◽  
Charles A. Kurtz ◽  
Darren R. Locke ◽  
John B. Parise ◽  
...  

The use of a polymeric Torlon (polyamide–imide) gasket material in a Paris–Edinburgh pressure cell forin situhigh-pressure X-ray scattering measurements is demonstrated. The relatively low bulk modulus of the gasket allows for fine control of the sample pressure over the range 0.01–0.42 GPa. The quality of the data obtained in this way is suitable for Bragg and pair distribution function analysis.


RSC Advances ◽  
2017 ◽  
Vol 7 (59) ◽  
pp. 37402-37411 ◽  
Author(s):  
U. P. Gawai ◽  
B. N. Dole

The atomic structures of nanowires were studied by X-ray atomic pair distribution function analysis and total synchrotron X-ray scattering data. A PDF method was used to describe a wurtzite and zinc-blended mixed phase model.


2019 ◽  
Vol 52 (1) ◽  
pp. 60-71 ◽  
Author(s):  
Agnieszka Poulain ◽  
Capucine Dupont ◽  
Pablo Martinez ◽  
Chamseddine Guizani ◽  
Jakub Drnec

A combination of wide-angle X-ray scattering (WAXS) and pair distribution function analysis was used to investigate the structural changes occurring in beech wood and apricot tree pruning samples during slow and fast pyrolysis up to 1400°C (1673 K). WAXS curve modeling with the program CarbX provides unique information about the arrangement of graphene layers described by intralayer, interlayer, disorder and dispersion structural parameters. Pair distribution function modeling in PDFgui revealed imperfections in single graphene sheets, such as bond shortening and curvature, when refinement is performed in different r ranges. The concentration of inorganic species, along with heating rate, influences the final structure of pyrolysis products. The heating rate was more important than sample composition for an increase in extent of the single graphene layer and average chord length, while the average graphene coherent stack height depended on both composition and heating rate. Higher fractions of inorganic material increased the average interlayer spacing and the number of graphene layers per stack.


2016 ◽  
Vol 49 (4) ◽  
pp. 1231-1239 ◽  
Author(s):  
T. Sibillano ◽  
L. De Caro ◽  
F. Scattarella ◽  
G. Scarcelli ◽  
D. Siliqi ◽  
...  

Bovine cornea was studied with scanning small-angle X-ray scattering (SAXS) microscopy, by using both synchrotron radiation and a microfocus laboratory source. A combination of statistical (adaptive binning and canonical correlation analysis) and crystallographic (pair distribution function analysis) approaches allowed inspection of the collagen lateral packing of the supramolecular structure. Results reveal (i) a decrease of the interfibrillar distance and of the shell thickness around the fibrils from the periphery to the center of the cornea, (ii) a uniform fibril diameter across the explored area, and (iii) a distorted quasi-hexagonal arrangement of the collagen fibrils. The results are in agreement with existing literature. The overlap between laboratory and synchrotron-radiation data opens new perspectives for further studies on collagen-based/engineered tissues by the SAXS microscopy technique at laboratory-scale facilities.


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