M¶ssbauer Spectroscopy and 1 M¶ssbauer Transition Metal
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123 – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – Philipp Gütlich Eckhard Bill Alfred X. Trautwein – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – Mössbauer Spectroscopy and Transition Metal Chemistry Fundamentals and Application
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Philipp Gütlich Eckhard Bill Alfred X. Trautwein
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Philipp Gütlich Eckhard Bill Alfred X. Trautwein
Mössbauer Spectroscopy and Transition Metal ChemistryFundamentals and Application
– – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – – –
Mössbauer Spectroscopy and Transition Metal ChemistryMössbauer spectroscopy is a profound analytical method which has nevertheless continued to develop. The authors now present a state-of-the art book which consists of two parts. The first part details the fundamentals of Mössbauer spectroscopy and is based on a book published in 1978 in the Springer series ’Inorganic Chemistry Concepts‘ by P. Gütlich, R. Link and A.X. Trautwein. The second part covers useful practical aspects of measurements, and the application of the techniques to many problems of materials cha-racterization. The update includes the use of synchroton radiation and many instructive and illustrative examples in fields such as solid state chemistry, biology and physics, materials and the geosciences, as well as industrial applications. Special chapters on magnetic relaxation phenomena (S. Morup) and computation of hyperfine interaction parameters (F. Neese) are also included.
An attached CD-ROM with more than 400 full-color PowerPoint images provides self-explanatory examples. After an initial period this supplementary material will be available at extra.springer.com
The book concentrates on teaching the technique using theory as much as needed and as little as possible. The reader will learn the fundamentals of the technique and how to apply it to many problems of materials characterization. Transition metal chemistry, studied on the basis of the most widely used Mössbauer isotopes, will be in the foreground.
CCoonntteennttss
I - Lecture notes: “Mössbauer Spectroscopy: Principles and Applications” (Philipp Gütlich)
II - Selected Applications of Mössbauer Spectroscopy
(contributions from different groups)
1. Physics 2. Chemistry 3. Biology 4. Geosciences 5. Archeology 6. Industrial application
III - Computation and Interpretation of Mössbauer Parameters
1. Mössbauer parameters from DFT-based WIEN2k calculations for extended systems (Peter Blaha)
2. Computation and Interpretation of Mössbauer Parameters of Fe-bearing Compounds (Michael Grodzicki and Stefan Lebernegg)
IV - Properties of Isotopes Relevant to Mössbauer
Spectroscopy (John G. Stevens, Airat M. Khasanov, Nina F. Hall, and Irina A. Khasanova)
V - “Mossbauer Spectroscopy and Transition Metal
Chemistry”, 1st edition Springer-Verlag, Berlin Heidelberg New York, 1978 P. Gütlich, R. Link, A. Trautwein
3. Appendix to Chapter 5:
(Frank Neese and Taras Petrenko)of Nuclear Inelastic Scattering Theory
Linear Response Theory and Mathematical Development
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Contents
Mössbauer Spectroscopy
Part I
Philipp Gütlich
Lecture series “Mössbauer Spectroscopy – Principles and Applications”
• Acknowledgement • Introduction • Principle of the Mössbauer Effect and Basic Concepts of
Mössbauer Spectroscopy • Experimental Resonance Conditions • Sharpness of resonance • Recoil Effect • Cross-section for Resonant Absorption • Comparison Between Electronic and Nuclear Transitions • Lattice dynamics • Lamb-Mössbauer-Factor (Debye-Waller-Factor) • Mössbauer-Experiment (Mössbauer spectrometer) • Hyperfine Interactions and Mössbauer parameters: • Isomer Shift • Electric Quadrupole Splitting • Magnetic Dipole Splitting
• Applications: • Transition Metal Compounds • Bioinorganic Compounds • Spin Crossover • Molecular magnetism • Mössbauer Emission Spectroscopy • Industrial Applications • Phase Transitions • Mobile Mössbauer Spectroscopy with MIMOS • MIMOS on Mars • MIMOS on Earth • Mössbauer Spectroscopy in Daily Life
Contents
Part II
Applications of Mössbauer spectroscopy: Contributions from different laboratories
1. Physics
Title of contribution Authors File name Determination of the size of Fe nano-grains in Ag
J. Balogh, D. Kaptás, L. F. Kiss, I. Vincze, A. Kovács, M. Csontos, G. Mihály
Balogh_Fe nano-grains.ppt
Independent magnetic ordering of the Er and Fe sublattices in ErFe6Sn6
J.M. Cadogan and D.H. Ryan
Cadogan_Magnetism of ErFe6Sn6.ppt
Comparing erbium moments derived from 166Er Mössbauer spectroscopy and neutron diffraction
D.H. Ryan, J.M. Cadogan
Cadogan_166Er MS of Er3Ge4.ppt
The first-order magnetostructural transition in Gd5Sn4
D.H. Ryan
Cadogan_119Sn MS in Gd5Sn4.ppt
Quantitative analysis of iron ore processing
J.M. Cadogan
Cadogan_Iron ore processing.ppt
169Tm Mössbauer Spectroscopy J.M. Cadogan
Cadogan_169Tm MS of Tm alloys.ppt
Yb valence in YbMn2(Si,Ge)2
J.M. Cadogan, D.H. Ryan
Cadogan_170Yb MS of YbMn2(SiGe)2.ppt
Integral Low-Energy Electron Mössbauer Spectroscopy (ILEEMS): a useful variant for true surface studies
E. De Grave, R. E. Vandenberghe
DeGrave_ILEEMS.ppt
σ-Phase in Fe-Cr and Fe-V Systems
S. M. Dubiel
Dubiel _sigma Phase in Fe-Cr and Fe-V.ppt
Harmonically modulated structures
S. M. Dubiel
Dubiel_Harmonically modulated structures.ppt
Ferric fluorides: crystalline, amorphous and nanostructured states
J. M. Greneche
Greneche_Ferric Fluorides.ppt
Rf-Mössbauer study of the magnetic properties of nanocrystalline FeNiZrB and FeNiCoZrB alloys
M. Kopcewicz, T. Kulik
Kopcewicz_Rf MS in FeNiZrB and FeNiCoZrB alloys.ppt
Crystallization of amorphous alloys induced by the rf magnetic field
M. Kopcewicz Kopcewicz_Amorphous alloys.ppt
Nanocrystalline alloys: I. Hyperfine Interactions
M. Miglierini et al.
Miglierini_Nanocrystalline alloys.part1.ppt
Nanocrystalline alloys: II. Hyperfine Interactions
M. Miglierini et al.
Miglierini_Nanocrystalline alloys.part2.ppt
Imaging the Magnetic Spin Structure of Exchange Coupled Thin Films
R. Röhlsberger
Roehlsberger_Spin Structure in Thin Films .ppt
Mössbauer spectroscopic studies
T.Shinjo Shinjo_Multilayers.ppt
Ditellurides of 3d transition metals studied by 57Fe and 125Te Mössbauer spectroscopy
P. Fornal, J. Stanek
Stanek_57Fe and 125Te of ditellurides.ppt
Relativistic Effects in Gold Chemistry. Part 1
J. Stanek
Stanek_Relativistic Effects in Au.part1.ppt
Relativistic Effects in Gold Chemistry. Part 2
J. Stanek
Stanek_Relativistic Effects in Au.part2.ppt
Nanosized magnetic clusters and their relation to magnetoresistance in FeCr2S4 spinel
Z. Klencsár, E. Kuzmann, Z. Homonnay, A. Vértes, A. Simopoulos, E. Devlin, G. Kallias
Klencsar_Magnetoresistance in FeCr2S4 spinel.ppt
Contents
2. Chemistry
Title of contribution Authors File name Mössbauer spectroscopy under magnetic field to explore the low temperature spin structure in a molecular layered ferrimagnet
A. Bhattacharjee, P. Gütlich et al.
Bhattacharjee_Layered Ferrimagnet.ppt
Metal-to-metal electron transfer and magnetic interactions in a mixed-valence Prussian blue analogue
A. Bhattacharjee, P. Gütlich et al.
Bhattacharjee_Prussian Blue Analogue.ppt
Fe(II) High Spin ↔ Low Spin Transition in [FeII(isoxazole)6](X)2, X = BF4, ClO4
A. Bhattacharjee, P. Gütlich et al.
Bhattacharjee_Spin crossover.ppt
Thermal and light-induced spin transition in iron compounds
P. Gütlich et al. Guetlich_Spin crossover.ppt
Mössbauer studies of the interaction of oxygen with solid β-FeIIphthalocyanine
E. Kuzmann, Z. Homonnay, A. Vértes, S. Li, H. Yin, Y. Wei, A. Nath, X. Chen, J. Li
Kuzmann_Fe_phthalocyanine.ppt
157 T internal magnetic field in Fe[C(SiMe3)3]2 compound at 20K
E. Kuzmann, R. Szalay, A. Vértes, Z. Homonnay, I. Pápai, P. de Châtel, L. Szepes
Kuzmann_Field in Fe[C(SiMe3)3]2.ppt
Nuclear inelastic scattering on spin crossover complexes
H. Paulsen and A.X. Trautwein
Luebeck_NIS_Spin crossover.ppt
Pressure-induced changes of the vibrational modes of spin-crossover complexes studied by nuclear resonance scattering of synchrotron radiation
A.X. Trautwein, H. Paulsen, H. Winkler H. Giefers, G. Wortmann H. Toftlund J.A. Wolny A.I. Chumakov, O. Leupold
Luebeck_NIS_Spin crossover_Pressure.ppt
Photoswitching of nitroprussides V. Rusanov, Sv. Stankov, H. Paulsen, A. X. Trautwein
Luebeck_Nitroprussides.ppt
Trinuclear mixed-valent oxo-centered iron complexes: fully localised, partially and fully delocalised valencies
R.W. Saalfrank, A. Scheurer, V. Schünemann, A.X. Trautwein
Luebeck_Trinuclear mixed valent.ppt
Unconventional valence transition in biferrocenium charge-transfer complexes
T. Mochida
Mochida_Biferrocenium.ppt
Exotic dimers part one: the case of the vanishing hyperfine field
W. M. Reiff, J.S. Miller, J. H. Zhang and D. O’Hare
Reiff_Donor Acceptor.ppt
Exotic dimers part two: a high-spin ferrous dimer that exhibits genuine spontaneous long range 3d-magnetic order in zero field and metamagnetism
W. M. Reiff, M. Feist, and E. Kemnitz
Reiff_HS Ferrous Dimer.ppt
Direct spectroscopic evidence of orbital magnetism of essentially free ion magnitude in a rigorously linear two-coordinate high-spin Fe (II) compound
W. M. Reiff, A. M. LaPointe, and C. E. Schulz
Reiff_Largest magnetic field.ppt
Zero and applied field Mössbauer spectroscopy investigations of magnetic frustration in certain classic Werner complexes above and below 1K
W. M. Reiff, L. Tákács, M. J. Kwiecien
Reiff_Magnetic frustration.ppt
Reversible, reductive, topotactic metal ion insertion chemistry of ferric networks à La Chimie Douce
W. M. Reiff, L. Tákács, J. Tákács, K. Lázár, C. C. Torardi
Reiff_Metal Ion Insertion.ppt
Spin states of highly deformed iron(III) porphyrin complexes studied by 57Fe Mössbauer spectroscopy
M. Nakamura, M. Takahashi
Takahashi_Porphyrins.ppt
Electronic phase separation in cobaltate perovskites
Z. Németh, Z. Klencsár, Z. Homonnay, E. Kuzmann, A. Vértes
Vertes_Cobaltate perovskites.ppt
Mössbauer spectroscopic study of the structure of an iron(III) complex with indole-3-acetic acid in acidic aqueous solutions
K. Kovács, A. A. Kamnev, E. Kuzmann, A. Vértes
Vertes_Indole complexes.ppt
Contents
3. Biology
Title of contribution Authors File name Time-dependent analysis of magnetite nanoparticles in magnetospirillum gryphiswaldense
L. H. Böttger, D. Faivre, D. Schüler, B. F. Matzanke
Luebeck_Nanoparticles in Magnetospirillum.ppt
Siderophore reductase FhuF - a case study
B. F. Matzanke Matzanke_Siderophore Reductase.ppt
Mössbauer spectroscopy of microbial iron metabolization
B. F. Matzanke, M. Brandenburger, L. H. Böttger
Matzanke_Microbial Iron Metabolization.ppt
Dynamics of proteins Mössbauer spectroscopy in energy and time
K. Achterhold, F.G. Parak
Parak_Dynamics of proteins.ppt
Intermediates in the reaction cycle of cytochrome P450cam
V. Schünemann, C. Jung, A.X. Trautwein
Schuenemann_Cytochrome P450.ppt
A comprehensive Mössbauer study of the iron uptake strategies in plants
K. Kovács, E. Kuzmann, F. Fodor , A. Vértes
Kovacs_Iron Uptake in Plants.ppt
Contents
4. Geoscience
Title of contribution Authors File name Green rusts and the corrosion of iron based materials
J.-M. R. Génin et al.
Genin_Green rust corrosion.ppt
The FeII-III oxyhydroxycarbonate fougerite mineral and green rusts in hydromorphous soils
J.-M. R. Génin et al.
Genin_Fougerite.ppt
FeII-III (oxy)hydroxycarbonate green rusts; from ferri- to ferromagnetism
J.-M. R. Génin et al.
Genin_Ferri- and ferromagnetism in green rust.ppt
Applications of Mössbauer spectroscopy to studies of the Earth’s interior
C. McCammon McCammon_Earth’s Interior.ppt
Mössbauer spectroscopy of geological materials
E. Murad
Murad_Geological materials.ppt
Contents
5. Archeology
Title of contribution Authors File name Selected Applications of MIMOS II in Archaeology
P. de Souza, G. Klingelhöfer, B. Bernhard, P. Gütlich
de Souza_Selected applications with MIMOS.ppt
Mössbauer Spectroscopy in Archaeology I: Precolumbian Pottery from Northern Peru
I. Shimada, U. Wagner, F. E. Wagner
Wagner_Precolumbian Pottery.ppt
Mössbauer Spectroscopy in Archaeology II: Celtic Ceramics in Central Europe
R. Gebhard, U. Wagner, F. E. Wagner
Wagner_Celtic Ceramics.ppt
Gold in Ruby Glass: A 197Au Mössbauer Study
S. Haslbeck, K.-P. Martinek, L. Stievano F. E. Wagner
Wagner Gold Glass.ppt
Contents
6. Industrial application
Title of contribution Authors File name Air Pollution Source Assessment using MIMOS II
P. de Souza, G. Klingelhöfer, P. Gütlich
de Souza_Environmental Studies with MIMOS.ppt
Chernobyl fallout studied by Mössbauer spectroscopy
V. Rusanov, V. Gushterov, H. Winkler, A. X. Trautwein
Luebeck_Chernobyl.ppt
Mössbauer measurements on dollar and euro money pigments
V. Rusanov, K. Chakarova, H. Winkler, A. X. Trautwein
Luebeck_Fake money.ppt
