A three-dimensional plasticity model was developed and applied to metal-intermetallic laminate composites containingphases of the L12 structure. A multi-scale approach that combined the methods of continuum mechanics ...A three-dimensional plasticity model was developed and applied to metal-intermetallic laminate composites containingphases of the L12 structure. A multi-scale approach that combined the methods of continuum mechanics and dislocationkinetics was used. This model takes account of the different mechanisms of self-locking superdislocations, the dislocationsand the dislocation walls＇ density storage for each type of layer at the micro-scale. At the meso-scale, the solutions to thedislocation kinetics equations, in the form of stress-strain curves, were used to create the properties of a three-dimensionalrepresentative element. The numerical simulation study of the macroscopic deformation was carried out with the finiteelement method using the dynamic model of continuum mechanics, which included the classical conservation laws,constitutive equations and the equation of state. It was shown that the simulation results generated using this model were ingood agreement with the mechanical tests conducted on the single crystals of the L12 structure. The model provides anexcellent description of the high-temperature plastic strain superlocalization effect of single crystal intermetallics of theLI2 structure. This paper describes the numerical results of the study of the tension and compression tests of metal-intermetallic laminate composites containing phases of the L12 structure. The model allows the description of the dis-tribution of the accumulated plastic strain inhomogeneities and is capable of predicting the strengthening properties andplastic behaviour of the metal-intermetallic laminate composites containing phases of the L12 structure.展开更多
By use of self-consistent field Xα scattered-wave (SCF-Xα-SW) method, the electronic structure was calculated for four models of Ti4Al14X (X=Al, Fe, Ni and Cu) clusters. The Ti4Al14X cluster was developed based on L...By use of self-consistent field Xα scattered-wave (SCF-Xα-SW) method, the electronic structure was calculated for four models of Ti4Al14X (X=Al, Fe, Ni and Cu) clusters. The Ti4Al14X cluster was developed based on L12 Al3Ti-base intermetallic compound. The results are presented using the density of states (DOS) and one-electron properties, such as relative binding tendency between the atom and the model cluster, and hybrid bonding tendency between the alloying element and the host atoms. By comparing the four models of Ti4Al14X cluster, the effect of the Fe, Ni or Cu atom on the physical properties of Al3Ti-based L12 intermetallic compounds is analyzed. The results indicate that the addition of the Fe, Ni or Cu atom intensifies the relative binding tendency between Ti atom and Ti4Al14X cluster. It was found that the Fermi level (EF) lies in a maximum in the DOS for Ti4Al14Al cluster; on the contrary, the EF comes near a minimum tn the DOS for Ti4Al14X (X=Fe, Ni and Cu) cluster. Thus the L12 crystal structure for binary Al3Ti alloy is unstable, and the addition of the Fe, Ni or Cu atom to Al3Ti is benefical to stabilize L12 crystal structure. The calculation also shows that the Fe, Ni or Cu atom strengthens the hybrid bonding tendency between the central atom and the host atoms for Ti4Al14X cluster and thereby may lead to the constriction of the lattice of Al3Ti-base intermetallic compounds.展开更多
基金financially supported by the Russian Science Foundation(No.17-72-10042)
文摘A three-dimensional plasticity model was developed and applied to metal-intermetallic laminate composites containingphases of the L12 structure. A multi-scale approach that combined the methods of continuum mechanics and dislocationkinetics was used. This model takes account of the different mechanisms of self-locking superdislocations, the dislocationsand the dislocation walls＇ density storage for each type of layer at the micro-scale. At the meso-scale, the solutions to thedislocation kinetics equations, in the form of stress-strain curves, were used to create the properties of a three-dimensionalrepresentative element. The numerical simulation study of the macroscopic deformation was carried out with the finiteelement method using the dynamic model of continuum mechanics, which included the classical conservation laws,constitutive equations and the equation of state. It was shown that the simulation results generated using this model were ingood agreement with the mechanical tests conducted on the single crystals of the L12 structure. The model provides anexcellent description of the high-temperature plastic strain superlocalization effect of single crystal intermetallics of theLI2 structure. This paper describes the numerical results of the study of the tension and compression tests of metal-intermetallic laminate composites containing phases of the L12 structure. The model allows the description of the dis-tribution of the accumulated plastic strain inhomogeneities and is capable of predicting the strengthening properties andplastic behaviour of the metal-intermetallic laminate composites containing phases of the L12 structure.
文摘By use of self-consistent field Xα scattered-wave (SCF-Xα-SW) method, the electronic structure was calculated for four models of Ti4Al14X (X=Al, Fe, Ni and Cu) clusters. The Ti4Al14X cluster was developed based on L12 Al3Ti-base intermetallic compound. The results are presented using the density of states (DOS) and one-electron properties, such as relative binding tendency between the atom and the model cluster, and hybrid bonding tendency between the alloying element and the host atoms. By comparing the four models of Ti4Al14X cluster, the effect of the Fe, Ni or Cu atom on the physical properties of Al3Ti-based L12 intermetallic compounds is analyzed. The results indicate that the addition of the Fe, Ni or Cu atom intensifies the relative binding tendency between Ti atom and Ti4Al14X cluster. It was found that the Fermi level (EF) lies in a maximum in the DOS for Ti4Al14Al cluster; on the contrary, the EF comes near a minimum tn the DOS for Ti4Al14X (X=Fe, Ni and Cu) cluster. Thus the L12 crystal structure for binary Al3Ti alloy is unstable, and the addition of the Fe, Ni or Cu atom to Al3Ti is benefical to stabilize L12 crystal structure. The calculation also shows that the Fe, Ni or Cu atom strengthens the hybrid bonding tendency between the central atom and the host atoms for Ti4Al14X cluster and thereby may lead to the constriction of the lattice of Al3Ti-base intermetallic compounds.
