X-ray absorption spectroscopy, EELS, and full-potential augmented plane wave study of the electronic structure ofTi2AlC,Ti2AlN,Nb2AlC, and(Ti0.5Nb0.5)2AlC

Physical Review B ◽

10.1103/physrevb.71.024105 ◽

2005 ◽

Vol 71 (2) ◽

Author(s):

G. Hug ◽

M. Jaouen ◽

M. W. Barsoum

Keyword(s):

Electronic Structure ◽

Absorption Spectroscopy ◽

Full Potential ◽

Augmented Plane Wave ◽

X Ray ◽

X Ray Absorption

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SOFT X-RAY ABSORPTION SPECTROSCOPY OF THE MgB2 BORON K EDGE IN AN MgB2/Mg COMPOSITE

Modern Physics Letters B ◽

10.1142/s0217984906011736 ◽

2006 ◽

Vol 20 (19) ◽

pp. 1207-1216 ◽

Author(s):

D. A. FISCHER ◽

A. R. MOODENBAUGH ◽

QIANG LI ◽

G. D. GU ◽

YIMEI ZHU ◽

...

Keyword(s):

Absorption Spectroscopy ◽

Sample Surface ◽

Fluorescence Yield ◽

Full Potential ◽

Augmented Plane Wave ◽

X Ray ◽

Plane Wave Method ◽

Edge Spectrum ◽

Linearized Augmented Plane Wave ◽

X Ray Absorption

Soft X-ray absorption spectroscopy (XAS), using fluorescence yield, was used to study the boron K near edge in MgB 2 superconductor. The sample consists of MgB 2 crystallites randomly oriented in a magnesium matrix. Abrasion of the sample surface in vacuum provides a surface relatively free of boron-containing impurities. The intrinsic boron K near edge spectrum of the sample at a temperature of 295 K is identified. This spectrum is then compared in detail with a spectrum calculated using the full potential linearized augmented plane wave method. Features predicted by the theory appear near the expected energies, with qualitative agreement regarding shape and intensity.

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Gas-liquid interface influencing electronic structure of phenol based on molecular dynamics simulations and theoretical X-ray absorption spectroscopy

Journal of Molecular Liquids ◽

10.1016/j.molliq.2021.117378 ◽

2021 ◽

Vol 341 ◽

pp. 117378

Author(s):

Shaofeng Xu ◽

Petr Lukes

Keyword(s):

Molecular Dynamics ◽

Electronic Structure ◽

Molecular Dynamics Simulations ◽

Absorption Spectroscopy ◽

Liquid Interface ◽

X Ray ◽

Dynamics Simulations ◽

X Ray Absorption

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An investigation of the electronic structure of Cu2FeSn3−xTixS8 (0≤x≤3) thiospinel spin-crossover materials by X-ray absorption spectroscopy and electronic structure calculations

Journal of Solid State Chemistry ◽

10.1016/j.jssc.2012.08.057 ◽

2013 ◽

Vol 197 ◽

pp. 532-542 ◽

Author(s):

John R. Hayes ◽

Andrew P. Grosvenor

Keyword(s):

Electronic Structure ◽

Absorption Spectroscopy ◽

Spin Crossover ◽

Electronic Structure Calculations ◽

X Ray ◽

X Ray Absorption ◽

Structure Calculations

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Electronic structure and magnetic states inLa1−xSrxCoO3studied by photoemission and x-ray-absorption spectroscopy

Physical Review B ◽

10.1103/physrevb.56.1290 ◽

1997 ◽

Vol 56 (3) ◽

pp. 1290-1295 ◽

Author(s):

T. Saitoh ◽

T. Mizokawa ◽

A. Fujimori ◽

M. Abbate ◽

Y. Takeda ◽

...

Keyword(s):

Electronic Structure ◽

Absorption Spectroscopy ◽

X Ray ◽

Magnetic States ◽

X Ray Absorption

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X-ray absorption spectra of hexagonal ice and liquid water by all-electron Gaussian and augmented plane wave calculations

The Journal of Chemical Physics ◽

10.1063/1.2928842 ◽

2008 ◽

Vol 128 (20) ◽

pp. 204506 ◽

Author(s):

Marcella Iannuzzi

Keyword(s):

Absorption Spectra ◽

Liquid Water ◽

Augmented Plane Wave ◽

X Ray ◽

Hexagonal Ice ◽

X Ray Absorption

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Lithium insertion mechanism in CoSb3analysed by121Sb Mössbauer spectrometry, X-ray absorption spectroscopy and electronic structure calculations

Journal of Materials Chemistry ◽

10.1039/b312618h ◽

2004 ◽

Vol 14 (11) ◽

pp. 1759-1767 ◽

Author(s):

Isabelle Devos ◽

Manfred Womes ◽

Mike Heilemann ◽

Josette Olivier-Fourcade ◽

Jean-Claude Jumas ◽

...

Keyword(s):

Electronic Structure ◽

Absorption Spectroscopy ◽

Electronic Structure Calculations ◽

Mössbauer Spectrometry ◽

Lithium Insertion ◽

X Ray ◽

Lithium Insertion Mechanism ◽

Insertion Mechanism ◽

X Ray Absorption ◽

Structure Calculations

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OXYGEN-DEPENDENT ELECTRONIC STRUCTURE IN POWDER AND SINGLE CRYSTAL OF YBa2Cu3O7−∂ OBSERVED IN-SITU BY X-RAY ABSORPTION SPECTROSCOPY

High Tc Superconductors ◽

10.1016/b978-0-08-037542-7.50028-4 ◽

1989 ◽

pp. 245-258 ◽

Author(s):

H. Tolentino ◽

E. Dartyge ◽

A. Fontaine ◽

G. Tourillon ◽

T. Gourieux ◽

...

Keyword(s):

Electronic Structure ◽

Single Crystal ◽

Absorption Spectroscopy ◽

X Ray ◽

X Ray Absorption

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Defects and oxygen vacancies tailored structural, optical and electronic structure properties of Co-doped ZnO nanoparticle samples probed using soft X-ray absorption spectroscopy

Vacuum ◽

10.1016/j.vacuum.2020.109538 ◽

2020 ◽

Vol 179 ◽

pp. 109538 ◽

Author(s):

Jyoti Sahu ◽

Swati Soni ◽

Sudhish Kumar ◽

B. Dalela ◽

P.A. Alvi ◽

...

Keyword(s):

Electronic Structure ◽

Absorption Spectroscopy ◽

Oxygen Vacancies ◽

Zno Nanoparticle ◽

X Ray ◽

Doped Zno ◽

X Ray Absorption ◽

Co Doped ◽

Structure Properties

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Local and electronic structure of Sr1-Gd TiO3 probed by X-ray absorption spectroscopy

Journal of Alloys and Compounds ◽

10.1016/j.jallcom.2020.157975 ◽

2020 ◽

pp. 157975

Author(s):

Alexandre Mesquita ◽

Elio Thizay Magnavita Oliveira ◽

Hugo Bonette de Carvalho

Keyword(s):

Electronic Structure ◽

Absorption Spectroscopy ◽

X Ray ◽

X Ray Absorption

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Electronic structure of BaTiO[sub 3] by X-ray absorption spectroscopy

10.1063/1.1363092 ◽

2001 ◽

Author(s):

K. Asokan

Keyword(s):

Electronic Structure ◽

Absorption Spectroscopy ◽

X Ray ◽

X Ray Absorption

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