NDLI: Inverse problem in XANES theory

Content Provider	Springer Nature Link
Author	Migal, Yu. F.
Copyright Year	2008
Abstract	The latest results obtained by a method based on the formalism of the poles of the S matrix are reported. The maxima of one-electron origin in the soft X-ray absorption spectra are assigned the coordinates of the S-matrix poles in a complex plane of energies for a model imitating a real system. The oscillator strengths and the heights of maxima are now additionally taken into account as the initial data along with the energies and widths of maxima. The role of the Watson sphere, which should be introduced in the muffintin models for molecules, is examined. The formalism for the combined inclusion of XANES and EXAFS was developed. This elaboration of the method allows an increased accuracy of inverse problem solving in the theory of X-ray absorption spectra compared to methods developed earlier.
Starting Page	92
Ending Page	101
Page Count	10
File Format	PDF
ISSN	00224766
Journal	Journal of Structural Chemistry
Volume Number	49
Issue Number	1
e-ISSN	15738779
Language	English
Publisher	Springer US
Publisher Date	2009-03-15
Publisher Place	Boston
Access Restriction	One Nation One Subscription (ONOS)
Subject Keyword	X-ray absorption spectra XANES EXAFS interatomic distances bond angles empirical one-electron potential Solid State Physics and Spectroscopy Atomic and Molecular Structure and Spectra Atoms, Molecules, Clusters and Plasmas Physical Chemistry Inorganic Chemistry
Content Type	Text
Resource Type	Article
Subject	Materials Chemistry Physical and Theoretical Chemistry Inorganic Chemistry

Sl.	Authority	Responsibilities	Communication Details
1	Ministry of Education (GoI), Department of Higher Education	Sanctioning Authority	https://www.education.gov.in/ict-initiatives
2	Indian Institute of Technology Kharagpur	Host Institute of the Project: The host institute of the project is responsible for providing infrastructure support and hosting the project	https://www.iitkgp.ac.in
3	National Digital Library of India Office, Indian Institute of Technology Kharagpur	The administrative and infrastructural headquarters of the project	Dr. B. Sutradhar bsutra@ndl.gov.in
4	Project PI / Joint PI	Principal Investigator and Joint Principal Investigators of the project	Dr. B. Sutradhar bsutra@ndl.gov.in Prof. Saswat Chakrabarti will be added soon
5	Website/Portal (Helpdesk)	Queries regarding NDLI and its services	support@ndl.gov.in
6	Contents and Copyright Issues	Queries related to content curation and copyright issues	content@ndl.gov.in
7	National Digital Library of India Club (NDLI Club)	Queries related to NDLI Club formation, support, user awareness program, seminar/symposium, collaboration, social media, promotion, and outreach	clubsupport@ndl.gov.in
8	Digital Preservation Centre (DPC)	Assistance with digitizing and archiving copyright-free printed books	dpc@ndl.gov.in
9	IDR Setup or Support	Queries related to establishment and support of Institutional Digital Repository (IDR) and IDR workshops	idr@ndl.gov.in

XANES Determination of Intraatomic Potentials

X-ray absorption near edge structure as a source of structural information

Construction of empirical MT-potentials of molecules: Role of the Watson sphere

Structure of Zn$_{3}$P$_{2}$

XPS and XANES studies of SnO$_{ x }$ nanolayers

Empirical model of orbital relaxation and interatomic distances in molecules with polar chemical bonds

Program for predicting interatomic distances in crystals by the bond valence method

X-ray diffraction investigation of siloxanes. III. Structure and configuration of cyclic tetra-and pentasiloxanes bearing different organic substituents at silicon atoms

Local atomic structure of zinc selenide films: EXAFS data

Inverse problem in XANES theory

Similar Documents

XANES Determination of Intraatomic Potentials

X-ray absorption near edge structure as a source of structural information

Construction of empirical MT-potentials of molecules: Role of the Watson sphere

Structure of Zn$_{3}$P$_{2}$

XPS and XANES studies of SnO$_{ x }$ nanolayers

Empirical model of orbital relaxation and interatomic distances in molecules with polar chemical bonds

Program for predicting interatomic distances in crystals by the bond valence method

X-ray diffraction investigation of siloxanes. III. Structure and configuration of cyclic tetra-and pentasiloxanes bearing different organic substituents at silicon atoms

Local atomic structure of zinc selenide films: EXAFS data

Inverse problem in XANES theory