Hydrogenation Effects of Ultrananocrystalline Diamond Detected by X-ray Absorption Near Edge Structure and Raman Spectroscopy

2012 ◽  
Vol 51 (9R) ◽  
pp. 095201 ◽  
Author(s):  
Sekhar C. Ray ◽  
Rudolph M. Erasmus ◽  
H. M. Tsai ◽  
C. W. Pao ◽  
I.-N. Lin ◽  
...  
Keyword(s):  
Raman Spectroscopy ◽  
Edge Structure ◽  
X Ray ◽  
Ultrananocrystalline Diamond ◽  
X Ray Absorption

Hydrogenation Effects of Ultrananocrystalline Diamond Detected by X-ray Absorption Near Edge Structure and Raman Spectroscopy

2012 ◽  
Vol 51 ◽  
pp. 095201 ◽  
Author(s):  
Sekhar C. Ray ◽  
Rudolph M. Erasmus ◽  
H. M. Tsai ◽  
C. W. Pao ◽  
I.-N. Lin ◽  
...  
Keyword(s):  
Raman Spectroscopy ◽  
Edge Structure ◽  
X Ray ◽  
Ultrananocrystalline Diamond ◽  
X Ray Absorption

The Structural Characterization of a Series of Uranium-containing Gadolinium Zirconates

2012 ◽  
Vol 1475 ◽  
Author(s):  
Daniel J. Gregg ◽  
Yingjie Zhang ◽  
Zhaoming Zhang ◽  
Inna Karatchevtseva ◽  
Mark G. Blackford ◽  
...  
Keyword(s):  
Raman Spectroscopy ◽  
Diffuse Reflectance ◽  
Charge Balance ◽  
X Ray Diffraction ◽  
Edge Structure ◽  
Gadolinium Zirconate ◽  
X Ray ◽  
Host Materials ◽  
X Ray Absorption

ABSTRACTA series of uranium-containing gadolinium zirconate samples have been fabricated at 1723 K in air. X-ray diffraction and Raman spectroscopy have confirmed pyrochlore or defect fluorite structures, while diffuse reflectance, X-ray absorption near edge structure and X-ray photoelectron spectroscopies indicate a predominantly U6+ oxidation state, even when Ca2+ was added to charge balance for U4+. The results demonstrate the potential of gadolinium zirconates as host materials for actinides.

scholarly journals Characterization of Pressure-induced Phase Transition on [Co(bpy)3](NO3)2·3H2O

2014 ◽  
Vol 70 (a1) ◽  
pp. C57-C57
Author(s):  
Ya-Wen Lee ◽  
Yu-Chun Chuang ◽  
Jyh-Fu Lee ◽  
Chi-Rung Lee ◽  
Chih-Ming Lin ◽  
...  
Keyword(s):  
Phase Transition ◽  
Raman Spectroscopy ◽  
Density Functional ◽  
Theoretical Calculations ◽  
Spin Transition ◽  
Xrd Analysis ◽  
External Pressure ◽  
Edge Structure ◽  
X Ray ◽  
X Ray Absorption

The pressure-induced phase transition study of high-spin (HS) compound, [Co(bpy)3](NO3)2·3H2O (bpy = 2,2'-bipyridine), is characterized by powder x-ray diffraction (XRD), x-ray absorption spectroscopy (XAS), Raman spectroscopy, and theoretical calculations. The results indicate that the HS ground state t2g5eg2 on Co(II) is gradually transformed to low-spin (LS) state with configuration t2g6eg1 . This phase transition behavior is similar to the thermal-induced spin crossover phenomenon once it is incorporated into certain framework. In this study, we put the compound into diamond anvil cell and applied physical pressure to replace the framework effect. To analyze the x-ray absorption near edge structure (XANES) and Raman spectroscopy, the finite difference method for near-edge structure (FDMNES) and density functional theory (DFT) calculations are applied to illustrate the experimental spectroscopies, respectively. In XANES results, an intersection point around 7756.33 eV beyond 1.73 GPa is assigned as the critical point between HS and LS state. The extended x-ray absorption fine structure (EXAFS) analysis indicates that the averaged Co-N bond lengths is 2.127(7) Å at HS state and decreased to 1.950(4) Å at LS state. Based on XRD analysis, the external pressure reduces the hexagonal cell constants from a = 13.77(3) Å and c = 21.71(3) Å to a = 13.37(5) Å and c = 21.11(1) Å. According to those experimental results, the mechanism of such pressure-induce spin transition can be interpreted as the enhancement of intermolecular interaction by increasing the external pressure.

Chemical and orientational imaging of polymeric samples

1994 ◽  
Vol 52 ◽  
pp. 68-69
Author(s):  
H. Ade ◽  
B. Hsiao ◽  
G. Mitchell ◽  
E. Rightor ◽  
A. P. Smith ◽  
...  
Keyword(s):  
Ethylene Terephthalate ◽  
National Laboratory ◽  
Brookhaven National Laboratory ◽  
Carbonyl Groups ◽  
Aromatic Rings ◽  
Edge Structure ◽  
X Ray ◽  
Scanning Transmission ◽  
Polymeric Samples ◽  
X Ray Absorption

We have used the Scanning Transmission X-ray Microscope at beamline X1A (X1-STXM) at Brookhaven National Laboratory (BNL) to acquire high resolution, chemical and orientation sensitive images of polymeric samples as well as point spectra from 0.1 μm areas. This sensitivity is achieved by exploiting the X-ray Absorption Near Edge Structure (XANES) of the carbon K edge. One of the most illustrative example of the chemical sensitivity achievable is provided by images of a polycarbonate/pol(ethylene terephthalate) (70/30 PC/PET) blend. Contrast reversal at high overall contrast is observed between images acquired at 285.36 and 285.69 eV (Fig. 1). Contrast in these images is achieved by exploring subtle differences between resonances associated with the π bonds (sp hybridization) of the aromatic groups of each polymer. PET has a split peak associated with these aromatic groups, due to the proximity of its carbonyl groups to its aromatic rings, whereas PC has only a single peak.

Full-Field Calcium K-Edge X-ray Absorption Near-Edge Structure Spectroscopy on Cortical Bone at the Micron-Scale: Polarization Effects Reveal Mineral Orientation

2016 ◽  
Vol 88 (7) ◽  
pp. 3826-3835 ◽  
Author(s):  
Bernhard Hesse ◽  
Murielle Salome ◽  
Hiram Castillo-Michel ◽  
Marine Cotte ◽  
Barbara Fayard ◽  
...  
Keyword(s):  
Cortical Bone ◽  
Edge Structure ◽  
Full Field ◽  
Polarization Effects ◽  
X Ray ◽  
X Ray Absorption

scholarly journals Database of ab initio L-edge X-ray absorption near edge structure

2021 ◽  
Vol 8 (1) ◽  
Author(s):  
Yiming Chen ◽  
Chi Chen ◽  
Chen Zheng ◽  
Shyam Dwaraknath ◽  
Matthew K. Horton ◽  
...  
Keyword(s):  
High Throughput ◽  
Scattering Theory ◽  
Research Community ◽  
Metal Compounds ◽  
Edge Structure ◽  
X Ray ◽  
Initial Release ◽  
Computational Workflow ◽  
X Ray Absorption

AbstractThe L-edge X-ray Absorption Near Edge Structure (XANES) is widely used in the characterization of transition metal compounds. Here, we report the development of a database of computed L-edge XANES using the multiple scattering theory-based FEFF9 code. The initial release of the database contains more than 140,000 L-edge spectra for more than 22,000 structures generated using a high-throughput computational workflow. The data is disseminated through the Materials Project and addresses a critical need for L-edge XANES spectra among the research community.

Theoretical and experimental investigation of point defects in cubic boron nitride

MRS Advances ◽  
2017 ◽  
Vol 2 (29) ◽  
pp. 1545-1550 ◽  
Author(s):  
Nicholas L. McDougall ◽  
Jim G. Partridge ◽  
Desmond W. M. Lau ◽  
Philipp Reineck ◽  
Brant C. Gibson ◽  
...  
Keyword(s):  
Boron Nitride ◽  
Cubic Boron Nitride ◽  
Optical Emission ◽  
Wide Band ◽  
Wide Band Gap ◽  
Edge Structure ◽  
X Ray ◽  
Substitutional Defects ◽  
X Ray Absorption ◽  
Annealing Experiments

ABSTRACTCubic boron nitride (cBN) is a synthetic wide band gap material that has attracted attention due to its high thermal conductivity, optical transparency and optical emission. In this work, defects in cBN have been investigated using experimental and theoretical X-ray absorption near edge structure (XANES). Vacancy and O substitutional defects were considered, with O substituted at the N site (ON) to be the most energetically favorable. All defects produce unique signatures in either the B or N K-edges and can thus be identified using XANES. The calculations coupled with electron-irradiation / annealing experiments strongly suggest that ON is the dominant defect in irradiated cBN and remains after annealing. This defect is a likely source of optical emission in cBN.

scholarly journals Plasma Fabrication and SERS Functionality of Gold Crowned Silicon Submicrometer Pillars

Materials ◽  
2020 ◽  
Vol 13 (5) ◽  
pp. 1244 ◽  
Author(s):  
Paola Pellacani ◽  
Carlo Morasso ◽  
Silvia Picciolini ◽  
Dario Gallach ◽  
Lucia Fornasari ◽  
...  
Keyword(s):  
Raman Spectroscopy ◽  
Surface Enhanced Raman Spectroscopy ◽  
Post Processing ◽  
Advanced Material ◽  
X Ray ◽  
Colloidal Monolayer ◽  
Surface Enhanced ◽  
Surface Enhanced Raman ◽  
Lift Off ◽  
X Ray Absorption

Sequential plasma processes combined with specific lithographic methods allow for the fabrication of advanced material structures. In the present work, we used self-assembled colloidal monolayers as lithographic structures for the conformation of ordered Si submicrometer pillars by reactive ion etching. We explored different discharge conditions to optimize the Si pillar geometry. Selected structures were further decorated with gold by conventional sputtering, prior to colloidal monolayer lift-off. The resulting structures consist of a gold crown, that is, a cylindrical coating on the edge of the Si pillar and a cavity on top. We analysed the Au structures in terms of electronic properties by using X-ray absorption spectroscopy (XAS) prior to and after post-processing with thermal annealing at 300 °C and/or interaction with a gold etchant solution (KI). The angular dependent analysis of the plasmonic properties was studied with Fourier transformed UV-vis measurements. Certain conditions were selected to perform a surface enhanced Raman spectroscopy (SERS) evaluation of these platforms with two model dyes, prior to confirming the potential interest for a well-resolved analysis of filtered blood plasma.

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