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Laser/Electron Beam Processing of As-cast Nd_2Fe_(14)B Alloy

HU Jiandong , ZHANG Xujun , SHI Zhusheng Microanalysis Center , Jilin University of Technology , Changchun , 130025 , China.Department of Metallurgy and Materials , University of Birmingham U.K.

材料科学技术(英)

It was found that the free Fe in the melted zone of the as—cast Nd_2Fe_(14)B alloy could be dissolved by Iaser/electron beam.The growth direction of Nd_2Fe_(14)B grains is nearly perpendicular to the sur- face of the samples.EDX examination showed that Fe element was homogeneously distributed in the melted zone.Results presented in this paper have giv- en hint to remove free Fe in as—cast Nd_2Fe_(14)B alloy.

关键词: Nd-Fe-B alloy , null

Atom location by channeling enhanced microanalysis study of site distributions of alloying elements in titanium aluminides

Journal of Materials Research

The original equation of Spence and Tafto for quantitative determination of site occupancy using atom location by channeling enhanced microanalysis method has been extended to take into account both delocalization effect and the influence of point defects (antisite atomic distribution and vacancies). The outcome of this treatment suggests that, for crystals free of antisite defects, the accuracy of site occupancy is influenced by delocalization effect but is independent of both thermal and structural vacancies. For crystals free of structural vacancies, the accuracy of site occupancy is influenced by both delocalization effect and antisite defects, but is independent of thermal vacancies. The delocalization effect was shown to vary with channeling strength at a given channeling condition. For a binary ordered phase in which at least one of the host elements exhibits weak delocalization effect las is the case for many transition-metal aluminides), a tangent-line method for obtaining the value of k (a parameter necessary for the calculation of site occupancy) was proposed, allowing the determination of the delocalization correction factor for the other host element. Application of this method to estimating the delocalization effect of Al in Ti3Al and TiAl under axial and planar channeling conditions, respectively, was demonstrated.

关键词: general formulation;electron-diffraction;x alloys;alchemi;occupancies;ti3al;additions

THE MICROSTRUCTURAL BANDING IN THE CENTER OF HOT ROLLING STRIP

C.L. Mo , Y.T. Zhang , D.Z. Li , Y.Y. Li

金属学报(英文版)

The microstructural banding in steels is often found in hot rolling strips, which plays a very important role in mechanical properties. Much work has been done to investigate how the microstructural banding is formed during hot rolling. In the present study, the microstructure of hot rolling strips was examined in term of optical microscopy and transmission electron microscopy. Electron probe microanalysis was also used to decide the distribution of microchemical bands, by this means, the phases in these strips were found to be ferrite and pearlite. The average distance between the carbon lamellas in pearlite is about 0.06-0.1μm. It is also shown that microstructural banding in hot rolled carbon steel was closely related to the segregation of manganese and silicon into those bands. Based on the transformation kinetic, the simulated results pointed out that the thermodynamic stability of austenite would increase with the increasing of Mn, which led to a decrease of ferrite growth rate. The effect of Mn on the decomposition of austenite is attributed to segregation of Mn atoms along the ferrite/austenite phase boundary which causes a strong solute drag effect. The addition of Mn to steel decreases the activity of austenite, thereby it is beneficial to the formation of non-equilibrium phase, such as degenerate pearlite. The formation of banded structure on the hot rolled process was discussed.

关键词: pearlite , null , null

Defect model for a tetragonal Co2+ impurity center in AgCl crystal

Materials Science and Engineering B-Solid State Materials for Advanced Technology

The EPR g-factors g(parallel to), g(perpendicular to) and hyperfine structure constants A(parallel to), A(perpendicular to) for a tetragonal Co2+ impurity center (i.e. Co2+ (II) center) in AgCl crystal are calculated by using the perturbation formulas of EPR parameters for the 3d(7) ion in tetragonal symmetry obtained from the cluster approach. Based on the calculations, the defect model for the center is suggested as a substitutional Co2+ ion associated with a nearest neighbour O2- ion. (C) 2001 Elsevier Science B.V. All rights reserved.

关键词: defect model;electron paramagnetic resonance;crystal-field theory;ligand-field theory;Co2+;AgCl;transition

Studies on the local structure of the tetragonal Er3+ center in CaO

Zeitschrift Fur Naturforschung Section a-a Journal of Physical Sciences

The local structure of the tetragonal Er3+ center in CaO is theoretically studied by using the perturbation formulas of the g factors for a 4f(11) ion in tetragonal symmetry. In these formulas, the contributions to the g factors from the second-order perturbation terms and the admixtures of various states are taken into account. Based on the investigations, this center is suggested to be the impurity Er3+ substituting the host Ca2+ site, associated with a Ca2+ vacancy V-Ca in the [100] (C-4) axis due to charge compensation. By studying the g factors of the tetragonal center, impurity Er3+ is expected to undergo an off-center displacement Delta Z( approximate to 0.2 A) towards the V-Ca along the C-4 axis because of the electrostatic attraction. The calculated g factors based on the displacement Delta Z show reasonable agreement with the observed values.

关键词: defect structures;electron paramagnetic resonance (EPR);crystal-field;and spin hamiltonians;Er3+;CaO;electron-spin-resonance;superposition-model;insulator coatings;magnesium-oxide;vanadium alloys;single-crystals;calcium oxide;parameters;blankets;ions

Studies on the EPR parameters for the rhombic Co2+ center in magnesium acetate

Zeitschrift Fur Naturforschung Section a-a Journal of Physical Sciences

The electron paramagnetic resonance (EPR) g factors g(i) (i = x,y,z) and the hyperfine structure constants A(i) for the rhombic Co2+ center in magnesium acetate are theoretically studied from the perturbation formulas of these parameters for a 3d(7) ion under rhombic symmetry. In these formulas, the contributions from the admixture among different states, covalency effect and rhombic crystal-fields are taken into account. The related crystal-field parameters are determined from the superposition model and the local geometrical relationship of the impurity center. The calculated results show reasonable agreement with the observed values. In addition, the nuclear quadrupole interaction constant is analyzed, and its negative sign is verified theoretically.

关键词: electron paramagnetic resonance (EPR);crystal- and ligand-fields;Co2+;magnesium acetate;atomic screening constants;paramagnetic-resonance;superposition model;aqueous-solutions;scf functions;g-tensor;crystal;fields;sites;liyf4

EPR paramaters and defect structure of the trigonal Ti2+ center in ZnS

Spectrochimica Acta Part a-Molecular and Biomolecular Spectroscopy

The axial Ti2+ center in a nearly wholly cubic ZnS crystal is assigned to the Ti2+ ion on the hexagonal site of wurtzite structure caused by stacking faults. On the ground of the assignment, the EPR parameters (zero-field splitting D, g factor g(parallel to) and g-anisotropy Delta g = g(parallel to) - g(perpendicular to)) of the axial Ti2+ center are calculated from the high-order perturbation formulas based on the cluster approach for the EPR parameters of 3d(2) ion in trigonal symmetry. From the calculations, the local atom-position parameter u(loc) (which is different from the corresponding parameter u in the host wurtzite structure) and hence the defect structure of the Ti" center are estimated. The results (the calculated EPR parameters and the defect structure) are discussed. (c) 2004 Elsevier B.V. All rights reserved.

关键词: electron paramagnetic resonance (EPR);local lattice distortion;crystal- and ligand-field;Ti2+;ZnS;electron-spin resonance;superposition model;zinc-sulfide;crystals;absorption;ions;fe3+;site

Analysis of Ground-State Zero-Field Splitting for Mn(2+) in ZnNbOF(5)center dot 6(H(2)O) and CoNbOF(5)center dot 6(H(2)O)

Chinese Physics Letters

The electron paramagnetic resonance spectra of trigonal Mn(2+) centers in ZnNbOF(5)center dot 6(H(2)O) and CoNbOF(5)center dot 6(H(2)O) crystals are studied on the basis of the complete energy matrices for a d(5) configuration ion in a trigonal ligand field. It is demonstrated that the local lattice structure around a trigonal Mn(2+) center has an elongation distortion along the crystalline c(3) axis, and when Mn(2+) is doped in the ZnNbOF(5)center dot 6(H(2)O) and CoNbOF(5)center dot 6(H(2)O) crystals, there is a similar local distortion. From the EPR calculation, the local lattice structure parameters for trigonal Mn(2+) centers in ZnNbOF(5)center dot 6(H(2)O) and CoNbOF(5)center dot 6(H(2)O) are determined.

关键词: phase-transition;ions;complexes;crystals;spectra;fe-3+;epr

Defect structure of Co2+ center in rhombohedral BaTiO3

Optical Materials

The spin-Hamiltonian parameters (g factor g(parallel to), gi(perpendicular to) and hyperfine structure constants A(parallel to), A(perpendicular to)) of Co2+ ion in rhombohedral BaTiO3 crystal are calculated from the perturbation formulas based on the cluster approach for the spin-Hamiltonian parameters of 3d(7) ion in trigonal octahedral site. The calculations are related to the trigonal field parameters and hence to the defect structure of Co2+ center. From the calculations, it is found that in order to reach a good fit between calculations and experiments, the off-center displacement of Co2+ ion in oxygen octahedron of BaTiO3 is much smaller than that of the host Ti4+ ion it replaces. This point is similar to the case of Fe3+ ion in BaTiO3 obtained in the previous studies by analyzing EPR zero-field splitting from the superposition model. (c) 2005 Elsevier B.V. All rights reserved.

关键词: defect structure;electron paramagnetic resonance;crystal and ligand;field;photorefractive material;Co2+;BaTiO3;electron-paramagnetic-resonance;atomic screening constants;photorefractive properties;superposition model;scf functions;dependence;position;distance;fields;sites

EPR investigation of the structure of a rhombic Co2+ center in an NaF crystal

Zeitschrift Fur Naturforschung Section a-a Journal of Physical Sciences

The local structure of the rhombic Co2+ center in NaF crystal is investigated by using the perturbation formulas of electron paramagnetic resonance (EPR) g factors g(i) (i - x,y,z) and hyperfine constants A(i) for a 3d(7) (Co2+) ion in rhombic octahedral symmetry based on a cluster approach. In these formulas, the contributions from the admixture among different states, covalency effect as well as rhombic crystal field are included. By studying the EPR data of the rhombic Co2+ center, one can reasonably obtain the local structural (or rhombic distortion) parameters DeltaR(c)(approximate to 0.268 Angstrom) for the central Co2+ and DeltaR(p)(approximate to 0. 181 Angstrom) for the two F- ions along [100] and [010] axes closest to the Na+ vacancy V-Na. The reasonableness of the results is also discussed.

关键词: local geometry;electron paramagnetic resonance (EPR);crystal- and;ligand field theory;NaF;Co2+;atomic screening constants;superposition model;scf functions;parameters;electrons;resonance;ions;cr3+

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