scholarly journals Resonant inelastic x-ray scattering spectra in the hyperhoneycomb iridate β−Li2IrO3 : First-principles calculations

2021 ◽  
Vol 103 (23) ◽  
Author(s):  
V. N. Antonov ◽  
D. A. Kukusta ◽  
L. Uba ◽  
A. Bonda ◽  
S. Uba
Keyword(s):  
First Principles ◽  
First Principles Calculations ◽  
X Ray ◽  
X Ray Scattering ◽  
Scattering Spectra ◽  
Ray Scattering

scholarly journals Lattice dynamics in FeSe via inelastic x-ray scattering and first-principles calculations

2020 ◽  
Vol 101 (3) ◽  
Author(s):  
Naoki Murai ◽  
Tatsuo Fukuda ◽  
Masamichi Nakajima ◽  
Mitsuaki Kawamura ◽  
Daisuke Ishikawa ◽  
...  
Keyword(s):  
First Principles ◽  
Lattice Dynamics ◽  
First Principles Calculations ◽  
X Ray ◽  
X Ray Scattering ◽  
Ray Scattering

Inelastic X-ray scattering in molecular liquids and electron correlation effects

1998 ◽  
Vol 5 (3) ◽  
pp. 1052-1054 ◽  
Author(s):  
Hisashi Hayashi ◽  
Noboru Watanabe ◽  
Yasuo Udagawa
Keyword(s):  
Structure Factor ◽  
Dynamic Structure ◽  
Basis Sets ◽  
Static Structure Factor ◽  
Correlation Effects ◽  
Static Structure ◽  
X Ray ◽  
X Ray Scattering ◽  
Scattering Spectra ◽  
Ray Scattering

Inelastic X-ray scattering spectra of liquid water and cyclohexane have been measured with 2 eV resolution for a momentum transfer range between 0.69 and 2.77 au at BL16A of the Photon Factory, KEK, Tsukuba. Observed spectra are transformed to the dynamic structure factor which is normalized by using the Bethe sum rule, and the static structure factor is obtained. From a comparison with extended CI calculations by the use of various basis sets, correlation effects are proved to be of vital importance in inelastic X-ray scattering.

Analysis of inelastic x-ray scattering spectra of low-temperature water

2000 ◽  
Vol 61 (2) ◽  
pp. 1518-1526 ◽  
Author(s):  
C. Y. Liao ◽  
S. H. Chen ◽  
F. Sette
Keyword(s):  
Low Temperature ◽  
X Ray ◽  
X Ray Scattering ◽  
Scattering Spectra ◽  
Temperature Water ◽  
Ray Scattering

scholarly journals Resonant inelastic soft X-ray scattering spectra at the nitrogen and carbon K-edges of poly(pyridine-2,5-diyl)

1999 ◽  
Vol 101-103 ◽  
pp. 573-578 ◽  
Author(s):  
M. Magnuson ◽  
L. Yang ◽  
J.-H. Guo ◽  
C. Såthe ◽  
A. Agui ◽  
...  
Keyword(s):  
X Ray ◽  
X Ray Scattering ◽  
Scattering Spectra ◽  
Ray Scattering
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