Structural analysis of molecular materials using the pair distribution function
This is a review of atomic pair distribution function (PDF) analysis as applied to the study of
molecular materials. The PDF method is a powerful approach to study short-and …
molecular materials. The PDF method is a powerful approach to study short-and …
Bridging structural inhomogeneity to functionality: pair distribution function methods for functional materials development
The correlation between structure and function lies at the heart of materials science and
engineering. Especially, modern functional materials usually contain inhomogeneities at an …
engineering. Especially, modern functional materials usually contain inhomogeneities at an …
Rapid-acquisition pair distribution function (RA-PDF) analysis
An image-plate (IP) detector coupled with high-energy synchrotron radiation was used for
atomic pair distribution function (PDF) analysis, with high probed momentum transfer …
atomic pair distribution function (PDF) analysis, with high probed momentum transfer …
Beyond crystallography: the study of disorder, nanocrystallinity and crystallographically challenged materials with pair distribution functions
Studying the structure of disordered and partially ordered materials is notoriously difficult.
Recently, significant advances have been made using the atomic pair distribution function …
Recently, significant advances have been made using the atomic pair distribution function …
Neutron and x-ray diffraction studies of liquids and glasses
The techniques of neutron diffraction and x-ray diffraction, as applied to structural studies of
liquids and glasses, are reviewed. Emphasis is placed on the explanation and discussion of …
liquids and glasses, are reviewed. Emphasis is placed on the explanation and discussion of …
Structure of V2O5·nH2O Xerogel Solved by the Atomic Pair Distribution Function Technique
A long-standing issue regarding the local and long-range structure of V2O5⊙ n H2O
xerogel has been successfully addressed. The full three-dimensional structure of the …
xerogel has been successfully addressed. The full three-dimensional structure of the …
ISAACS–interactive structure analysis of amorphous and crystalline systems
ISAACS (interactive structure analysis of amorphous and crystalline systems) is a cross-
platform program developed to analyze the structural characteristics of three-dimensional …
platform program developed to analyze the structural characteristics of three-dimensional …
Structural, vibrational, and elastic properties of a calcium aluminosilicate glass from molecular dynamics simulations: the role of the potential
M Bauchy - The Journal of chemical physics, 2014 - pubs.aip.org
We study a calcium aluminosilicate glass of composition (SiO 2) 0.60 (Al 2 O 3) 0.10 (CaO)
0.30 by means of molecular dynamics. To this end, we conduct parallel simulations …
0.30 by means of molecular dynamics. To this end, we conduct parallel simulations …
[HTML][HTML] Nanostructure by high-energy X-ray diffraction
V Petkov - Materials Today, 2008 - Elsevier
Detailed knowledge of the atomic-scale structure is needed to understand and predict
properties of materials. For ordinary crystals, this information is obtained by traditional …
properties of materials. For ordinary crystals, this information is obtained by traditional …
Applications of an amorphous silicon-based area detector for high-resolution, high-sensitivity and fast time-resolved pair distribution function measurements
The application of a large-area (41× 41 cm, 2048× 2048 or 1024× 1024 pixel) high-
sensitivity (detective quantum efficiency> 65%) fast-readout (up to 7.5 or 30 Hz) flat-panel …
sensitivity (detective quantum efficiency> 65%) fast-readout (up to 7.5 or 30 Hz) flat-panel …