CAJ | 학술논문

根据系统合金科学的思想,结合实验晶格常数和生成热,综合考虑合金能量、体积、原子状态之间的相互关系,确定BCC结构Nb-Mo合金系的相互作用方程为第9方程；同时,确定Nb-Mo合金系中Nb和Mo特征原子序列和特征晶体序列的基本信息；根据无序合金的特征原子浓度计算了无序Nb(1-x)Mox合金的电子结构和物理性质,其物理性质的变化趋势与电子结构的变化极其一致.
근거계통합금과학적사상,결합실험정격상수화생성열,종합고필합금능량、체적、원자상태지간적상호관계,학정BCC결구Nb-Mo합금계적상호작용방정위제9방정；동시,학정Nb-Mo합금계중Nb화Mo특정원자서렬화특정정체서렬적기본신식；근거무서합금적특정원자농도계산료무서Nb(1-x)Mox합금적전자결구화물이성질,기물이성질적변화추세여전자결구적변화겁기일치.
Comprehensively considering energy,volume and electronic structure of alloys,the ninth equation was determined as the interaction function of Nb-Mo alloys system in BCC structure on the basis of idea of systematic science of alloys,experimental lattice constants and heats of formation of disordered Nb(1-x)Mox alloys.The structural parameters and properties of Nb and Mo characteristic atoms sequences and corresponding characteristic crystals sequences were determined in Nb-Mo alloys system.The electronic structure and physical properties of disordered Nb(1-x)Mox alloys system were calculated according to concentration of characteristic atoms of disordered alloys.The change trend of physical properties is the same as that of electronic structure.