An analysis of segregation-induced changes in grain boundary cohesion in bcc iron

We thoroughly compare available experimental as well as theoretical values of the strengthening/embrittling energy of numerous solutes at grain boundaries in α-iron and assess their reliability. The strengthening/embrittling energy is displayed according to its relationship to the difference of corresponding sublimation enthalpies of the host and the solute as well as with regard to the position of the solute in the Periodic Table.     

Interactive grain boundary segregation of nickel and antimony in iron

Abstract

A study of the grain boundary segregation of nickel and antimony in iron is reported in the present paper. It is shown by the results that antimony segregation increases as the bulk nickel and antimony concentrations increase. However, once the solubility limit for antimony in iron is exceeded, the amount of segregation remains essentially constant. Segregation of nickel in iron increases as the bulk concentration of nickel increases and as the bulk concentration of antimony increases. The last effect is observed only when a certain level of antimony is reached, a level that depends on the concentration of nickel. Small additions of antimony, even though they cause an increase in segregation of antimony, do not cause an increase in segregation of nickel and, once the solubility limit for nickel in Fe–Sb alloys is exceeded, the segregation of nickel reaches a plateau. It is only between these two regimes that segregation of nickel is affected by changes in the concentration of antimony. All these results can be explained based on the mutual effects that nickel and antimony have on the solubility of each in iron. The results are not consistent with models based on cosegregation. Finally, other data in the literature are examined; all these data can be explained by an argument based on solubility changes.

MST/795     

A new challenge: grain boundary engineering for advanced materials by magnetic field application

This paper gives an overview of “Grain boundary engineering (GBE) for advanced materials by magnetic field application” based on recent experimental work performed on different kinds of structural and functional materials. It is shown that magnetic field application has a great potential and unique advantage as “non-contact processing” for microstructure control, irreplaceable by any other existing processing methods. The control of grain growth and texture by magnetic fields has been found to be generally applicable to many metallic materials, irrespective of whether they are ferromagnetic or not. Grain growth which is controlled by grain boundary migration was found to be strongly affected by magnetic field application. Recent attempts at the grain boundary engineering by magnetic field application through phase transformation have revealed that magnetic phase transformation can provide us a new approach to grain boundary engineering for iron alloys and steels, as well as a new nanocrystalline material produced by magnetic crystallization from the amorphous state. The possibility of engineering applications of enhanced densification using magnetic sintering and magnetic rejuvenation has been discussed for iron powder compacts and deformation-damaged iron alloys, respectively.     

First-principles study on the effect and magnetism of iron segregation in Cu grain boundary

The atomic configurations and electronic structures of iron on CuΣ5 symmetrical tilt grain boundary (GB) have been studied based on the density functional theory. Different segregation positions of iron are considered. A weak tendency of iron segregating to GB is arrived due to the segregation energy. In addition, iron segregation shows a cohesion strengthening effect of Cu GB according to Rice–Wang model, which is mainly contributed by the charge redistribution. Finally, an enhancement of the local magnetic moment of iron in Cu GB or bulk or surface is explored due to larger atomic volume than the FCC iron crystal and the Cu atoms surrounding iron are slightly polarized by the doped iron. This study can enrich the understanding of the effects of iron on the cohesion of Cu–Fe alloy and also might supply an indirect guidance to expand the application of Cu–Fe alloy in electronic device manufacture field.     

Relation between grain boundary segregation and grain boundary character in FCC alloys

An analytical model of segregation at grain boundaries, which takes into account all five macroscopic parameters of grain boundary character, has been developed. The model is based on a combination of previous bond energy treatments of grain boundary energy and of segregation to free surfaces. It is tested by comparing its predictions against previous computations of segregation to symmetrical twist grain boundaries in simple fcc alloys obtained by Monte Carlo simulations in conjunction with embedded atom method potentials. The comparison shows good agreement with the previous computer simulations. Examples of model predictions in the case of asymmetric grain boundaries are also provided.     

Influence of vanadium on grain boundary segregation of phosphorus in iron and iron-carbon alloys

The influence of vanadium on grain boundary segregation of phosphorus has been studied in iron and iron-carbon alloys by means of fracture experiments in a scanning Auger microprobe. The emphasis here is to study the effects of vanadium on the interaction processes operative under circumstances when structure in the interior of the grain (in the present case carbide formation) and grain boundary segregation form simultaneously. It is emphasized that to predict and analyse the behaviour of an alloy, it is important to consider atomic interactions both at the grain boundaries and in the grain interior and that between the constituents and the grain boundaries. The study suggests that the principal determining factor in the scavenging or retardation of migration of phosphorus to the grain boundaries is whether vanadium is present in the combined form (say, carbide) or is available in solid solution form. When vanadium is present in solid solution form, grain boundary segregation of phosphorus is low because of the chemical interaction of vanadium and phosphorus. However, as carbon is increasingly introduced in the alloy, vanadium now preferentially reacts with carbon in view of higher interaction for carbon as compared to phosphorus. A consequence of this is the increase in the grain boundary concentration of phosphorus. In such a situation the presence of excess carbon in addition to what is stoichiometrically required to precipitate the entire vanadium as vanadium carbides, serves as a palliative with regard to the reduction in the intergranular concentration of phosphorus. This palliative behaviour is explained in terms of the sitecompetition model. An effort is also made to examine the behaviour of segregating elements in terms of whole range of probable interactions (both at the grain boundaries and in the grain interior) and chemical interaction energies.     

Grain boundary motion and grain growth in zinc in a high magnetic field

The motion of grain boundaries in zinc bicrystals (99.995 %) driven by the “magnetic” driving force was measured. An in situ technique for observations and continuous recording the boundary migration was applied. Planar symmetrical and asymmetrical $ \left\langle {10\overline{1} 0} \right\rangle $ tilt grain boundaries with rotation angles in the range between 60° and 90° were studied. The boundary migration was measured in the temperature regime between 330 and 415 °C. The mobility of $ \left\langle {10\overline{1} 0} \right\rangle $ tilt boundaries in zinc and its temperature dependence were found to depend on the misorientation angle and the inclination of the boundary plane. An application of a magnetic field during the annealing of cold rolled (90 %) zinc–1.1 % aluminum alloy sheet specimens substantially affected the texture and microstructure evolution. This effect is attributed to the additional magnetic driving force for grain growth arising due to the magnetic anisotropy of zinc.     

Effect of the simultaneous application of a high static magnetic field and a low alternating current on grain structure and grain boundary of pure aluminum

Effect of the simultaneous application of a high static magnetic field and a low alternating electric current on the solidification structure of pure aluminum has been investigated. Results show that the refinement of the solidification structure is enhanced by the electric current under a certain magnetic field. However, when the magnetic field intensity exceeds a certain value, the refinement is impaired under a certain electric current. The observation by electron backscattered diffraction (EBSD) shows the complex fields have led to the increase of the low angle boundaries with the refinement. Moreover, the application of the static gradient magnetic field is capable of modifying the distribution of the refined grains. The above results may be attributed to the formation of the cavities during the electromagnetic vibration process and the high magnetic field.     

The segregation of osmium to grain boundary dislocations in tungsten

Field ion atom probe data is presented which shows that trace amounts of nickel and osmium segregate to grain boundaries in tungsten. The nickel atoms are randomly distributed in the grain boundary plane whereas the osmium is strongly segregated to the core region of a grain boundary dislocation. The differences in behavior of the solute atoms is explained by comparing atomic volumes.     

Non-equilibrium segregation of solute to grain boundary

The behaviour of boron segregation to grain boundaries in Fe-3%Si has been studied by means of particle tracking autoradiography. The results indicate that (i) the binding energy between boron atoms and grain boundaries is 55.7±1.7 kJ mol^–1; (ii) in contrast to the nature of boron segregation in -Fe, no observable non-equilibrium segregation of boron to grain boundaries exists in Fe-3%Si alloy during cooling and isothermal holding.     

Kinetics of grain boundary segregation during recrystallisation annealing

Abstract

In batch annealing and continuous annealing processes, both recrystallisation and grain boundary segregation can occur. In this paper, a simple model is derived which explores the interaction of the boundary migration and segregation processes and considers the application to phosphorus segregation during the annealing of interstitial free steels. The model considers both segregation to a migrating boundary and the segregation which occurs during continuous cooling after the holding period during the anneal cycle.     

Some aspects of the anisotropy of grain boundary segregation and wetting

A recently developed model of grain boundary (GB) segregation, in terms of the five macroscopic parameters of GB orientation, has been exercised to explore the anisotropy of GB segregation. The five macroscopic GB orientation parameters are defined by means of the orientations of the two crystallographic planes that terminate the crystals on either side of the GB, and a twist angle. Some important conclusions include the following: (a) the composition of a boundary depends on all five parameters of GB orientation, (b) the segregation profile across a GB depends on the two planes which terminate the adjacent crystals, (c) the composition profile across GB’s terminated by identical crystallographic planes is symmetric, but is asymmetric when GB’s are terminated by different planes, and (d) the strength of the segregation on one side of a GB influences the extent of segregation on the other. Some experimental results on Nb-doped TiO₂ are presented in order to verify above predicted trends. In addition, it is shown that the model predicts the possibility of anisotropic GB wetting transitions as two-phase coexistence is approached.     

The effects of thermal processing in a magnetic field on grain boundary characters of ferrite in a medium carbon steel

Effects of a magnetic field on low-angle misorientation distribution and CSL boundary occurrence in ferrite in 42CrMo steel during the austenite to ferrite and pearlite transformation were investigated. The results show that a magnetic field can considerably lower the frequency of low-angle misorientations in ferrite lamellae and raise the occurrence of Σ coincidence boundaries, especially Σ 3 in ferrite. But no obvious effect on crystallographic orientation distribution, or texture, was detected.     

The influence of grain boundary segregation on the rate of contact melting in metals

The contact melting of polycrystalline solid solutions with metals is studied. The linear correlations between the average rate of contact melting and (i) the energy of interaction between the impurity atoms and grain boundaries and (ii) differences in properties of constituents of solid solutions (namely differences in surface energies, electron work functions and generalized statistical V.K. Semenchenko moments) are revealed. Found relations demonstrate the importance of grain boundary segregation in the contact melting phenomenon.