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The Resource Multiple scattering theory for spectroscopies : a guide to multiple scattering computer codes -- dedicated to C. R. Natoli on the occasion of his 75th birthday, Didier Sébilleau, Keisuke Hatada, Hubert Ebert, editors, (electronic book)

Multiple scattering theory for spectroscopies : a guide to multiple scattering computer codes -- dedicated to C. R. Natoli on the occasion of his 75th birthday, Didier Sébilleau, Keisuke Hatada, Hubert Ebert, editors, (electronic book)

Editor
Contributor
Summary
This edited book, based on material presented at the EU Spec Training School on Multiple Scattering Codes and the following MSNano Conference, is divided into two distinct parts. The first part, subtitled zbasic knowledgey, provides the basics of the multiple scattering description in spectroscopies, enabling readers to understand the physics behind the various multiple scattering codes available for modelling spectroscopies. The second part, zextended knowledgey, presents zstate- of-the-arty short chapters on specific subjects associated with improving of the actual description of spectroscopies within the multiple scattering formalism, such as inelastic processes, or precise examples of modelling
Language
eng
Work
Publication
Extent
1 online resource.
Contents
  • Intro; Foreword; Preface; Acknowledgements; Contents; Contributors; Acronyms; Spectroscopies; Methods; Codes; Part I Basic knowledge; 1 Introduction to (Multiple) Scattering Theory; 1.1 Introduction; 1.2 Elementary Scattering Theory; 1.2.1 The Asymptotical Behaviour of the Wave Function; 1.2.2 The Radial Equation for the Spherically Symmetric Problem; 1.2.3 Partial Wave Expansions; 1.2.4 The Scattering Amplitude; 1.2.5 Calculation of the Phase Shifts; 1.3 Formal Scattering Theory; 1.3.1 The Free Electron Propagator; 1.3.2 The Full Propagator; 1.3.3 The Transition Operator
  • 1.3.4 The Møller Wave Operator1.3.5 Use of Outgoing and Ingoing States; 1.3.6 Two-Potential Formula; 1.4 Multiple Scattering Theory; 1.4.1 The Translation Operator; 1.4.2 The Muffin-Tin Approximation; 1.4.3 The Transition Operator of the System; 1.4.4 Normalization Issues; 1.4.5 Computing the Scattering Path Operator; 1.5 Expression of the Cross-Sections; 1.5.1 General Expression; 1.5.2 Cross-Section for Some Spectroscopies; References; 2 Generating Phase-Shifts and Radial Integrals for Multiple Scattering Codes; 2.1 Introduction; 2.2 Derivation of the Cross-Section for Various Spectroscopies
  • 2.2.1 Cross Section for Incoming Photons2.2.2 Cross Section for Incoming Electrons; 2.3 Multiple Scattering Theory; 2.3.1 Expression of Cross Sections in MST; 2.3.2 The Green's Function Approach to Photoabsorption: Real Potential; 2.3.3 The Green's Function Approach to Photoabsorption: Complex Potential; 2.4 An All-Purpose Optical Potential; 2.4.1 The Construction of the Muffin-Tin Potential; 2.4.2 The Construction of the Exchange-Correlation Potential; 2.4.3 Generating Phase Shifts and Atomic Cross Sections; 2.4.4 Calculating EELS Matrix Elements; References
  • 3 Real Space Full Potential Multiple Scattering Theory3.1 Introduction; 3.2 Multiple Scattering Theory; 3.2.1 The Local Solutions; 3.2.2 The L-Convergence of Full Potential Multiple Scattering Theory; 3.2.3 Construction of the Green's Function in MST; 3.2.4 Spectroscopic Response Functions; 3.3 The Program; 3.3.1 Features and Capabilities; 3.3.2 Requirements; 3.4 MT Versus FP Calculations; 3.5 Future Perspectives; 3.5.1 Optimization; 3.5.2 Other Spectroscopies; References; 4 KKR Green's Function Method in Reciprocal and Real Space; 4.1 Introduction to the KKR Green's Function Method
  • 4.1.1 General Features4.1.2 Treatment of Disorder; 4.1.3 Many-Body Effects: LSDA+DMFT Within the KKR Formalism; 4.2 Applications of KKR-Green Function Formalism in the Spectroscopy; 4.2.1 X-ray Absorption: Formalism; 4.2.2 X-Ray Absorption and X-Ray Magnetic Circular Dichroism of Clusters; 4.2.3 Modeling the Structure of Glasses; 4.2.4 Interdiffusion at Interface: Interplay Between Electronic and Real Structure; 4.2.5 Doped Materials; 4.2.6 Angular Resolved Photoemission; References; 5 Multichannel Multiple Scattering Theory in R-Matrix Formalism; 5.1 Introduction
Isbn
9783319738116
Instance
Label
Multiple scattering theory for spectroscopies : a guide to multiple scattering computer codes -- dedicated to C. R. Natoli on the occasion of his 75th birthday
Title
Multiple scattering theory for spectroscopies
Title remainder
a guide to multiple scattering computer codes -- dedicated to C. R. Natoli on the occasion of his 75th birthday
Statement of responsibility
Didier Sébilleau, Keisuke Hatada, Hubert Ebert, editors
Contributor
Editor
Honouree
Subject
Language
eng
Summary
This edited book, based on material presented at the EU Spec Training School on Multiple Scattering Codes and the following MSNano Conference, is divided into two distinct parts. The first part, subtitled zbasic knowledgey, provides the basics of the multiple scattering description in spectroscopies, enabling readers to understand the physics behind the various multiple scattering codes available for modelling spectroscopies. The second part, zextended knowledgey, presents zstate- of-the-arty short chapters on specific subjects associated with improving of the actual description of spectroscopies within the multiple scattering formalism, such as inelastic processes, or precise examples of modelling
Member of
Cataloging source
N$T
Dewey number
530.4/16
Index
index present
LC call number
QC173.4.M85
Literary form
non fiction
Nature of contents
  • dictionaries
  • bibliography
http://library.link/vocab/relatedWorkOrContributorDate
  • 1959-
  • 1955-
http://library.link/vocab/relatedWorkOrContributorName
  • Natoli, C. R.
  • Sébilleau, Didier
  • Hatada, Keisuke
  • Ebert, Hubert
http://library.link/vocab/subjectName
  • Multiple scattering (Physics)
  • Spectrum analysis
  • Physics
  • Spectroscopy and Microscopy
  • Numerical and Computational Physics, Simulation
  • Surface and Interface Science, Thin Films
Label
Multiple scattering theory for spectroscopies : a guide to multiple scattering computer codes -- dedicated to C. R. Natoli on the occasion of his 75th birthday, Didier Sébilleau, Keisuke Hatada, Hubert Ebert, editors, (electronic book)
Instantiates
Publication
Bibliography note
Includes bibliographical references and index
Carrier category
online resource
Carrier category code
  • cr
Carrier MARC source
rdacarrier
Content category
text
Content type code
  • txt
Content type MARC source
rdacontent
Contents
  • Intro; Foreword; Preface; Acknowledgements; Contents; Contributors; Acronyms; Spectroscopies; Methods; Codes; Part I Basic knowledge; 1 Introduction to (Multiple) Scattering Theory; 1.1 Introduction; 1.2 Elementary Scattering Theory; 1.2.1 The Asymptotical Behaviour of the Wave Function; 1.2.2 The Radial Equation for the Spherically Symmetric Problem; 1.2.3 Partial Wave Expansions; 1.2.4 The Scattering Amplitude; 1.2.5 Calculation of the Phase Shifts; 1.3 Formal Scattering Theory; 1.3.1 The Free Electron Propagator; 1.3.2 The Full Propagator; 1.3.3 The Transition Operator
  • 1.3.4 The Møller Wave Operator1.3.5 Use of Outgoing and Ingoing States; 1.3.6 Two-Potential Formula; 1.4 Multiple Scattering Theory; 1.4.1 The Translation Operator; 1.4.2 The Muffin-Tin Approximation; 1.4.3 The Transition Operator of the System; 1.4.4 Normalization Issues; 1.4.5 Computing the Scattering Path Operator; 1.5 Expression of the Cross-Sections; 1.5.1 General Expression; 1.5.2 Cross-Section for Some Spectroscopies; References; 2 Generating Phase-Shifts and Radial Integrals for Multiple Scattering Codes; 2.1 Introduction; 2.2 Derivation of the Cross-Section for Various Spectroscopies
  • 2.2.1 Cross Section for Incoming Photons2.2.2 Cross Section for Incoming Electrons; 2.3 Multiple Scattering Theory; 2.3.1 Expression of Cross Sections in MST; 2.3.2 The Green's Function Approach to Photoabsorption: Real Potential; 2.3.3 The Green's Function Approach to Photoabsorption: Complex Potential; 2.4 An All-Purpose Optical Potential; 2.4.1 The Construction of the Muffin-Tin Potential; 2.4.2 The Construction of the Exchange-Correlation Potential; 2.4.3 Generating Phase Shifts and Atomic Cross Sections; 2.4.4 Calculating EELS Matrix Elements; References
  • 3 Real Space Full Potential Multiple Scattering Theory3.1 Introduction; 3.2 Multiple Scattering Theory; 3.2.1 The Local Solutions; 3.2.2 The L-Convergence of Full Potential Multiple Scattering Theory; 3.2.3 Construction of the Green's Function in MST; 3.2.4 Spectroscopic Response Functions; 3.3 The Program; 3.3.1 Features and Capabilities; 3.3.2 Requirements; 3.4 MT Versus FP Calculations; 3.5 Future Perspectives; 3.5.1 Optimization; 3.5.2 Other Spectroscopies; References; 4 KKR Green's Function Method in Reciprocal and Real Space; 4.1 Introduction to the KKR Green's Function Method
  • 4.1.1 General Features4.1.2 Treatment of Disorder; 4.1.3 Many-Body Effects: LSDA+DMFT Within the KKR Formalism; 4.2 Applications of KKR-Green Function Formalism in the Spectroscopy; 4.2.1 X-ray Absorption: Formalism; 4.2.2 X-Ray Absorption and X-Ray Magnetic Circular Dichroism of Clusters; 4.2.3 Modeling the Structure of Glasses; 4.2.4 Interdiffusion at Interface: Interplay Between Electronic and Real Structure; 4.2.5 Doped Materials; 4.2.6 Angular Resolved Photoemission; References; 5 Multichannel Multiple Scattering Theory in R-Matrix Formalism; 5.1 Introduction
Extent
1 online resource.
Form of item
online
Isbn
9783319738116
Media category
computer
Media MARC source
rdamedia
Media type code
  • c
Other control number
10.1007/978-3-319-73811-6
System control number
  • (OCoLC)1030892436
  • on1030892436
Label
Multiple scattering theory for spectroscopies : a guide to multiple scattering computer codes -- dedicated to C. R. Natoli on the occasion of his 75th birthday, Didier Sébilleau, Keisuke Hatada, Hubert Ebert, editors, (electronic book)
Publication
Bibliography note
Includes bibliographical references and index
Carrier category
online resource
Carrier category code
  • cr
Carrier MARC source
rdacarrier
Content category
text
Content type code
  • txt
Content type MARC source
rdacontent
Contents
  • Intro; Foreword; Preface; Acknowledgements; Contents; Contributors; Acronyms; Spectroscopies; Methods; Codes; Part I Basic knowledge; 1 Introduction to (Multiple) Scattering Theory; 1.1 Introduction; 1.2 Elementary Scattering Theory; 1.2.1 The Asymptotical Behaviour of the Wave Function; 1.2.2 The Radial Equation for the Spherically Symmetric Problem; 1.2.3 Partial Wave Expansions; 1.2.4 The Scattering Amplitude; 1.2.5 Calculation of the Phase Shifts; 1.3 Formal Scattering Theory; 1.3.1 The Free Electron Propagator; 1.3.2 The Full Propagator; 1.3.3 The Transition Operator
  • 1.3.4 The Møller Wave Operator1.3.5 Use of Outgoing and Ingoing States; 1.3.6 Two-Potential Formula; 1.4 Multiple Scattering Theory; 1.4.1 The Translation Operator; 1.4.2 The Muffin-Tin Approximation; 1.4.3 The Transition Operator of the System; 1.4.4 Normalization Issues; 1.4.5 Computing the Scattering Path Operator; 1.5 Expression of the Cross-Sections; 1.5.1 General Expression; 1.5.2 Cross-Section for Some Spectroscopies; References; 2 Generating Phase-Shifts and Radial Integrals for Multiple Scattering Codes; 2.1 Introduction; 2.2 Derivation of the Cross-Section for Various Spectroscopies
  • 2.2.1 Cross Section for Incoming Photons2.2.2 Cross Section for Incoming Electrons; 2.3 Multiple Scattering Theory; 2.3.1 Expression of Cross Sections in MST; 2.3.2 The Green's Function Approach to Photoabsorption: Real Potential; 2.3.3 The Green's Function Approach to Photoabsorption: Complex Potential; 2.4 An All-Purpose Optical Potential; 2.4.1 The Construction of the Muffin-Tin Potential; 2.4.2 The Construction of the Exchange-Correlation Potential; 2.4.3 Generating Phase Shifts and Atomic Cross Sections; 2.4.4 Calculating EELS Matrix Elements; References
  • 3 Real Space Full Potential Multiple Scattering Theory3.1 Introduction; 3.2 Multiple Scattering Theory; 3.2.1 The Local Solutions; 3.2.2 The L-Convergence of Full Potential Multiple Scattering Theory; 3.2.3 Construction of the Green's Function in MST; 3.2.4 Spectroscopic Response Functions; 3.3 The Program; 3.3.1 Features and Capabilities; 3.3.2 Requirements; 3.4 MT Versus FP Calculations; 3.5 Future Perspectives; 3.5.1 Optimization; 3.5.2 Other Spectroscopies; References; 4 KKR Green's Function Method in Reciprocal and Real Space; 4.1 Introduction to the KKR Green's Function Method
  • 4.1.1 General Features4.1.2 Treatment of Disorder; 4.1.3 Many-Body Effects: LSDA+DMFT Within the KKR Formalism; 4.2 Applications of KKR-Green Function Formalism in the Spectroscopy; 4.2.1 X-ray Absorption: Formalism; 4.2.2 X-Ray Absorption and X-Ray Magnetic Circular Dichroism of Clusters; 4.2.3 Modeling the Structure of Glasses; 4.2.4 Interdiffusion at Interface: Interplay Between Electronic and Real Structure; 4.2.5 Doped Materials; 4.2.6 Angular Resolved Photoemission; References; 5 Multichannel Multiple Scattering Theory in R-Matrix Formalism; 5.1 Introduction
Extent
1 online resource.
Form of item
online
Isbn
9783319738116
Media category
computer
Media MARC source
rdamedia
Media type code
  • c
Other control number
10.1007/978-3-319-73811-6
System control number
  • (OCoLC)1030892436
  • on1030892436

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