High resolution 1s core hole X-ray spectroscopy in 3d transition metal complexes—electronic and structural information
暂无分享,去创建一个
[1] M. Frey. Nickel-iron hydrogenases: Structural and functional properties , 1988 .
[2] Armin Meisel,et al. X-Ray Spectra and Chemical Binding , 1989 .
[3] Fabrizio,et al. High resolution X-ray resonant Raman scattering. , 1995, Physical Review Letters.
[4] S. Cramer,et al. Spin selective x‐ray absorption spectroscopy: Demonstration using high resolution Fe Kβ fluorescence , 1994 .
[5] W. Kohn,et al. Self-Consistent Equations Including Exchange and Correlation Effects , 1965 .
[6] J. V. Vleck,et al. The theory of electric and magnetic susceptibilities , 1934, The Mathematical Gazette.
[7] A. Pierik,et al. Biological activition of hydrogen , 1997, Nature.
[8] U. Bergmann,et al. High Resolution K Capture X-ray Fluorescence Spectroscopy: A New Tool for Chemical Characterization , 1999 .
[9] K. Hodgson,et al. A Multiplet Analysis of Fe K-Edge 1s → 3d Pre-Edge Features of Iron Complexes , 1997 .
[10] H. Mendel,et al. X-ray kβ emission spectra and energy levels of compounds of 3D-transition metals-II : non-oxidic compounds , 1970 .
[11] P. Petit,et al. Oxidation state and coordination of Fe in minerals: An Fe K-XANES spectroscopic study , 2001 .
[12] P. Carra,et al. Anisotropic x-ray anomalous diffraction and forbidden reflections , 1994 .
[13] C. Brouder. Angular dependence of X-ray absorption spectra , 1990 .
[14] R. D. Cowan,et al. The Theory of Atomic Structure and Spectra , 1981 .
[15] H. Mao,et al. Magnetism in FeO at Megabar Pressures from X-Ray Emission Spectroscopy , 1999 .
[16] Guillaume Fiquet,et al. Iron Partitioning in Earth's Mantle: Toward a Deep Lower Mantle Discontinuity , 2003, Science.
[17] Deutsch,et al. K alpha and K beta x-ray emission spectra of copper. , 1995, Physical review. A, Atomic, molecular, and optical physics.
[18] J. Schulz,et al. Suppression of the low-spin multiplet components in the 3p photoelectron spectra of atomic and solid 3d metals , 2000 .
[19] Stuart A. Rice,et al. Inorganic Electronic Spectroscopy , 1968 .
[20] Stefan Eisebitt,et al. Band structure information and resonant inelastic soft X-ray scattering in broad band solids , 2000 .
[21] M. Weissbluth. Atoms and Molecules , 1978 .
[22] U. Bergmann,et al. Characterization of the Mn Oxidation States in Photosystem II by Kβ X-ray Fluorescence Spectroscopy , 1998 .
[23] S. Cheong,et al. Valence measurement of Mn oxides using Mn Kβ emission spectroscopy , 2000 .
[24] Mau H. Chen,et al. Atomic inner-shell level energies determined by absorption spectrometry with synchrotron radiation , 1980 .
[25] E. Cairns,et al. Electronic structure of chemically-prepared LixMn2O4 determined by Mn x-ray absorption and emission spectroscopies , 2000 .
[26] Schnopper. MULTIPLE EXCITATION AND IONIZATION OF INNER ATOMIC SHELLS BY X RAYS. Research Report No. 9 , 1963 .
[27] Shik Shin,et al. Polarization Dependence of Resonant X-Ray Emission Spectra in $3d^{n}$ Transition Metal Compounds with $n = 0$, 1, 2, 3 , 2002 .
[28] D. Siddons,et al. Optical design and performance of the inelastic scattering beamline at the National Synchrotron Light Source , 1995 .
[29] Peter Fulde,et al. Electron correlations in molecules and solids , 1991 .
[30] K. Hodgson,et al. L-edge X-ray absorption spectroscopy of non-heme iron sites: experimental determination of differential orbital covalency. , 2003, Journal of the American Chemical Society.
[31] J. Rubensson. RIXS dynamics for beginners , 2000 .
[32] N. Brookes,et al. ELECTRON-CORRELATION-INDUCED MAGNETIC ORDER OF ULTRATHIN MN FILMS , 1997 .
[33] A. Ankudinov,et al. Calculation and interpretation of K-shell x-ray absorption near-edge structure of transition metal oxides , 2003 .
[34] H. Adachi,et al. Electronic structures of 3d transition metal (Ti–Cu) oxides probed by a core hole , 1999 .
[35] C. Friedrich,et al. Unusual FTIR and EPR properties of the H2‐activating site of the cytoplasmic NAD‐reducing hydrogenase from Ralstonia eutropha , 2000, FEBS letters.
[36] K. Tsutsumi,et al. X-ray Mn K β emission spectra of manganese oxides and manganates , 1976 .
[37] Robert G. Parr,et al. Density Functional Theory of Electronic Structure , 1996 .
[38] J. Rehr,et al. Theoretical approaches to x-ray absorption fine structure , 2000 .
[39] Coen de Graaf,et al. Multiconfigurational Perturbation Theory: An Efficient Tool to Predict Magnetic Coupling Parameters in Biradicals, Molecular Complexes, and Ionic Insulators , 2001 .
[40] D. Siddons,et al. Spin-dependent x-ray absorption of MnO and MnF2. , 1992, Physical review. B, Condensed matter.
[41] C. Ballhausen,et al. Introduction to Ligand Field Theory , 1962 .
[42] Dräger,et al. Electronic structure of alpha -Al2O3 studied by polarized x-ray-emission spectroscopy. , 1990, Physical review. B, Condensed matter.
[43] B. L. Henke,et al. X-Ray Interactions: Photoabsorption, Scattering, Transmission, and Reflection at E = 50-30,000 eV, Z = 1-92 , 1993 .
[44] M. Tanaka,et al. Resonant X-Ray Scattering from Orbital Ordering in LaMnO 3 , 1998 .
[45] K. Höppner,et al. Spectrometer for high resolution resonant inelastic x‐ray scatteringa) , 1995 .
[46] Jean-Marie Dubois,et al. On experimental attenuation factors of the amplitude of the EXAFS oscillations in absorption, reflectivity and luminescence measurements , 1982 .
[47] Saeki,et al. Photoemission satellites and electronic structure of Fe2O3. , 1986, Physical review. B, Condensed matter.
[48] Kao,et al. X-ray resonant Raman scattering in NiO: Resonant enhancement of the charge-transfer excitations. , 1996, Physical review. B, Condensed matter.
[49] M. Martins,et al. 2p Photoionization of atomic Ni: a comparison with Ni metal and NiO photoionization. , 2002, Physical review letters.
[50] A. Nesvizhskii,et al. Hole counts from X-ray absorption spectra. , 2001, Journal of synchrotron radiation.
[51] U. Bergmann,et al. Absence of Mn-centered oxidation in the S(2) --> S(3) transition: implications for the mechanism of photosynthetic water oxidation. , 2001, Journal of the American Chemical Society.
[52] J. V. Vleck. The Dirac Vector Model in Complex Spectra , 1934 .
[53] C. Natoli,et al. X-ray absorption spectroscopy: state-of-the-art analysis. , 2003, Journal of synchrotron radiation.
[54] U. Bergmann,et al. Mn K-edge XANES and Kbeta XES studies of two Mn-oxo binuclear complexes: investigation of three different oxidation states relevant to the oxygen-evolving complex of photosystem II. , 2001, Journal of the American Chemical Society.
[55] Taniguchi,et al. Interatomic contributions to molecular x-ray emission rates. , 1990, Physical review. B, Condensed matter.
[56] R. Greene,et al. Energy and polarization dependence of resonant inelastic X-ray scattering in Nd2CuO4 , 2000 .
[57] W. H. Armstrong,et al. High-resolution manganese X-ray fluorescence spectroscopy. Oxidation-state and spin-state sensitivity , 1994 .
[58] F. D. Groot,et al. Site-selective XAFS: a new tool for catalysis research , 2000 .
[59] A. Manthiram,et al. Structural investigations of Li{sub 1.5+x}Na{sub 0.5}MnO{sub 2.85}I{sub 0.12} electrodes by Mn X-ray absorption near edge spectroscopy , 2000 .
[60] P. Zimmermann,et al. XUV spectroscopy of metal atoms , 1992 .
[61] Suzuki,et al. Charge-transfer effect on the linewidth of Fe K alpha x-ray fluorescence spectra. , 1994, Physical review. B, Condensed matter.
[62] D. A. Shirley,et al. Multiplet splitting of core-electron binding energies in transition-metal ions , 1969 .
[63] Y. Izumi,et al. Site-Selective X-Ray Absorption Fine Structure (XAFS) Spectroscopy. (1) Design of Fluorescence Spectrometer and Emission Spectra , 2000 .
[64] M. Abbate,et al. XPS and XAS spectra of CaMnO3 and LaMnO3 , 2002 .
[65] J C Fontecilla-Camps,et al. Hydrogenase: a hydrogen-metabolizing enzyme. What do the crystal structures tell us about its mode of action? , 1997, Biochimie.
[66] G. Aromí,et al. Synthesis of 3d metallic single-molecule magnets , 2006 .
[67] S. Albracht,et al. The [NiFe] hydrogenase from Allochromatiumvinosum studied in EPR-detectable states: H/D exchange experiments that yield new information about the structure of the active site , 2001, JBIC Journal of Biological Inorganic Chemistry.
[68] H. H. Johann,et al. Die Erzeugung lichtstarker Röntgenspektren mit Hilfe von Konkavkristallen , 1931 .
[69] M. Krause,et al. Natural widths of atomic K and L levels, Kα X‐ray lines and several KLL Auger lines , 1979 .
[70] Lad,et al. Photoemission study of the valence-band electronic structure in FexO, Fe3O4, and alpha -Fe2O3 single crystals. , 1989, Physical review. B, Condensed matter.
[71] García,et al. Multielectron excitations in the K-edge x-ray-absorption near-edge spectra of V, Cr, and Mn 3d0 compounds with tetrahedral coordination. , 1991, Physical review. B, Condensed matter.
[72] Herman Winick,et al. X-Ray Resonant Raman Scattering: Observation of Characteristic Radiation Narrower than the Lifetime Width , 1976 .
[73] Eric L. Shirley,et al. AB INITIO INCLUSION OF ELECTRON-HOLE ATTRACTION : APPLICATION TO X-RAY ABSORPTION AND RESONANT INELASTIC X-RAY SCATTERING , 1998 .
[74] Akio Kotani,et al. Resonant inelastic x-ray scattering spectra for electrons in solids , 2001 .
[75] Edward A. Stern,et al. New Technique for Investigating Noncrystalline Structures: Fourier Analysis of the Extended X-Ray—Absorption Fine Structure , 1971 .
[76] Ma. X-ray absorption, emission, and resonant inelastic scattering in solids. , 1994, Physical review. B, Condensed matter.
[77] Kawai,et al. Multiplet structure in Ni K beta x-ray fluorescence spectra of nickel compounds. , 1990, Physical review letters.
[78] Resonant X-ray scattering in transition metal and rare-earth materials , 2001 .
[79] P. Platzman,et al. Resonant inelastic x-ray scattering , 1998 .
[80] Direct evidence from gas-phase atomic spectra for an unscreened intra-atomic origin of outer-core multiplet splittings in solid manganese compounds. , 1988, Physical review letters.
[81] M. A. Blokhin. X-ray spectroscopy , 1962 .
[82] D. Koningsberger,et al. X-ray absorption : principles, applications, techniques of EXAFS, SEXAFS and XANES , 1988 .
[83] J. Hastings,et al. 1s2p resonant inelastic x-ray scattering in alpha-Fe2O3 , 1998 .
[84] U. Bergmann,et al. Site-selective EXAFS in mixed-valence compounds using high-resolution fluorescence detection: a study of iron in Prussian Blue. , 2002, Inorganic chemistry.
[85] R. S. Mulliken. Electronic Population Analysis on LCAO–MO Molecular Wave Functions. I , 1955 .
[86] L. Curtiss,et al. Intermolecular interactions from a natural bond orbital, donor-acceptor viewpoint , 1988 .
[87] S. Friedrich,et al. A multichannel superconducting soft x-ray spectrometer for high-resolution spectroscopy of dilute samples , 2002 .
[88] T. Konishi,et al. Relation between 2p X-ray photoelectron and Kα X-ray emission spectra of manganese and iron oxides , 1999 .
[89] V. Yachandra. X-ray absorption spectroscopy and applications in structural biology. , 1995, Methods in enzymology.
[90] H. Ågren,et al. Kramers–Heisenberg and Weisskopf–Wigner descriptions of resonant X-ray Raman scattering , 2000 .
[91] H. Gray,et al. Anisotropic valence→core x-ray fluorescence from a [Rh(en)3][Mn(N)(CN)5]⋅H2O single crystal: Experimental results and density functional calculations , 2002 .
[92] A. Gossard,et al. Magnetic ordering of a d1 compound: VF4 , 1974 .
[93] Deutsch,et al. Onset and near threshold evolution of the Cu K alpha x-ray satellites. , 1996, Physical review letters.
[94] U. Bergmann,et al. Influence of the core hole on Kß emission following photoionization or orbital electron capture: a comparison using MnO and 55Fe2O3 , 2001 .
[95] B. K. Agarwal,et al. X-Ray Spectroscopy: An Introduction , 1979 .
[96] G. Materlik,et al. On the Multipole Character of the X‐Ray Transitions in the Pre‐Edge Structure of Fe K Absorption Spectra. An Experimental Study , 1988 .
[97] C. Brouder,et al. Calculation of multipole transitions at the Fe K pre-edge through p-d hybridization in the Ligand Field Multiplet model , 2000 .
[98] F. D. Groot,et al. Hidden states and new peaks in resonant X-ray emission and resonant photoemission 1 Presented at the , 1998 .
[99] Thole,et al. Multiplet structure in the L2,3 x-ray-absorption spectra: A fingerprint for high- and low-spin Ni2+ compounds. , 1988, Physical review. B, Condensed matter.
[100] C. cohen-tannoudji,et al. Quantum Mechanics: , 2020, Fundamentals of Physics II.
[101] Dräger,et al. Polarized O K alpha and Cu L alpha x-ray emission spectra of Bi-Sr-Ca-Cu-O single crystals. , 1991, Physical review. B, Condensed matter.
[102] G. Sawatzky,et al. Local spin-flip spectral distribution obtained by resonant x- ray Raman scattering , 1998 .
[103] S. Aksela,et al. The resonant Auger effect , 2000 .
[104] E. J. Konopinski. The Theory of Beta Radioactivity , 1966 .
[105] G. Dräger,et al. Polarized X‐Ray Emission Spectra of Single Crystals , 1984 .
[106] T. Uozumi,et al. Theory of many-body effects in valence, core-level and isochromat spectroscopies along the 3d transition metal series of oxides , 1995 .
[107] A. Novakovich,et al. Experimental and Theoretical Studies of Fine Structure in Polarized Ni K X-Ray Absorption Spectra of NiO Single Crystals , 2001 .
[108] T. Uozumi,et al. Theory of X-Ray Photoemission and X-Ray Emission Spectra in Mn Compounds. , 1997 .
[109] C. Kao,et al. K β resonant x-ray emission spectra in MnF 2 , 2000 .
[110] J. Griffith,et al. The Theory of Transition-Metal Ions , 1962 .
[111] F. D. Groot,et al. High-Resolution X-ray Emission and X-ray Absorption Spectroscopy , 2001 .
[112] C. R. Brundle,et al. Electron Spectroscopy: Theory, Techniques and Applications , 1979 .
[113] P. Wood,et al. The determination of the valency of manganese in minerals by X-ray fluorescence spectroscopy , 1978 .
[114] D. Siddons,et al. A high‐resolution x‐ray fluorescence spectrometer for near‐edge absorption studies , 1991 .
[115] C. Joachain,et al. Physics of atoms and molecules , 1982 .
[116] A. L. Lacey,et al. Structure of the [Nife] Hydrogenase Active Site: Evidence for Biologically Uncommon Fe Ligands , 1996 .
[117] H. Renevier,et al. ELECTRON POPULATION ANALYSIS BY FULL-POTENTIAL X-RAY ABSORPTION SIMULATIONS , 1999 .
[118] Uwe Bergmann,et al. Chemical dependence of interatomic X-ray transition energies and intensities – a study of Mn Kβ″ and Kβ2, 5 spectra , 1999 .
[119] M. Chan,et al. Ligand Field Strengths and Oxidation States from Manganese L-Edge Spectroscopy , 1991 .
[120] Shen,et al. Resonant x-ray diffraction near the iron K edge in hematite ( alpha -Fe2O3). , 1992, Physical review letters.
[121] K. Sakurai,et al. Chemical characterization using relative intensity of manganese Kβ′ and Kβ5 X-ray fluorescence , 2003 .
[122] F. D. Groot,et al. X-ray absorption and dichroism of transition metals and their compounds , 1994 .
[123] D. Siddons,et al. Elimination of the inner-shell lifetime broadening in x-ray-absorption spectroscopy. , 1991, Physical review letters.
[124] U. Bergmann,et al. Electronic structure of Ni complexes by X-ray resonance Raman spectroscopy (resonant inelastic X-ray scattering). , 2002, Journal of the American Chemical Society.
[125] Stefan Eisebitt,et al. It’s always a one-step process , 1997 .
[126] R. M. Jones,et al. Nickel L-Edge Soft X-ray Spectroscopy of Nickel−Iron Hydrogenases and Model CompoundsEvidence for High-Spin Nickel(II) in the Active Enzyme , 2000 .
[127] E. Büyükkasap,et al. Chemical-effect variation of Kβ/Kα X-ray intensity ratios in 3d elements , 2002 .
[128] G. Sawatzky,et al. Comparison of x-ray absorption with x-ray photoemission of nickel dihalides and NiO. , 1986, Physical review. B, Condensed matter.
[129] Tetsuya Nakamura,et al. Magnetic Circular Dichroism of Resonant X-Ray Emission Spectroscopy in Longitudinal and Transverse Geometries , 2001 .
[130] P. Eisenberger,et al. Fluorescence detection of EXAFS: Sensitivity enhancement for dilute species and thin films , 1977 .
[131] H. Schnopper. ATOMIC READJUSTMENT TO AN INNER-SHELL VACANCY: MANGANESE K X-RAY EMISSION SPECTRA FROM AN $sup 55$Fe K-CAPTURE SOURCE AND FROM THE BULK METAL. , 1967 .
[132] W. D. de Jong,et al. Atomic many-body effects for the p-shell photoelectron spectra of transition metals. , 2000, Physical review letters.
[133] H. Ågren,et al. Dynamical properties of X-ray Raman scattering , 2003 .
[134] C. Kao,et al. Lifetime-broadening removed X-ray absorption near edge structure by resonant inelastic X-ray scattering spectroscopy , 2003 .
[135] Saitoh,et al. Electronic structure of 3d-transition-metal compounds by analysis of the 2p core-level photoemission spectra. , 1992, Physical review. B, Condensed matter.
[136] E. Beaurepaire,et al. Experimental and Theoretical Investigation of the Pre-Peaks at the Ti K-Edge Absorption Spectra in TiO2 , 1992 .
[137] Zhiwei Hu,et al. On the electronic structure of Cu(III) and Ni(III) in La2Li1/2Cu1/2O4, Nd2Li1/2Ni1/2O4, and Cs2KCuF6 , 1998 .
[138] B. Poumellec,et al. ANGULAR DEPENDENCE OF THE TI K EDGE IN RUTILE TIO2 , 1991 .
[139] J. Rehr. Excited state electronic structure and the theory of x-ray spectra , 2003 .
[140] J. Leiro,et al. High-energy-spectroscopy studies of a charge-transfer insulator: X-ray spectra of α-Fe2O3 , 1992 .
[141] F. D. Groot,et al. 3s2p inelastic x-ray scattering of CaF2 , 1996 .