U3Si2核燃料孔隙演化的三维相场模拟

Three-dimensional Phase-field Simulation of Void Evolution in U3Si2 Nuclear Fuel

  • 摘要: U3Si2较UO2具有更高的热导率和铀密度,故被考虑用作UO2的耐事故替代燃料。然而U3Si2燃料在辐照过程中产生大量的点缺陷易簇聚成孔隙或气泡导致肿胀,影响燃料的服役性能和寿命。本文采用三维相场方法研究了裂变密度对U3Si2燃料孔隙演化的影响。结果表明:孔隙平均半径〈R〉与裂变密度FD幂律相关,满足关系式〈R〉∝FzD,幂指数z为0.45;孔隙尺寸分布呈对数正态分布,与裂变密度无关。孔隙平均尺寸随裂变密度的增加而变大,大致在2〜20 nm范围内。空位数量、孔隙率、肿胀率和裂变密度呈正相关,孔隙浓度随裂变密度迅速增加后缓慢减少至稳定值。当裂变密度为14×1020 cm-3时,孔隙浓度约为1.6×1016 cm-3,孔隙率约为0.1,燃料体积的肿胀率不超过3%。模拟结果与实验值吻合较好。

     

    Abstract: Up to now, uranium dioxide (UO2) is widely used in water-cooled nuclear reactors. It has the characteristics of high melting temperature, splendid irradiation stability, and excellent fission product capacity. However, UO2 has a lower thermal conductivity, even its thermal conductivity decreases significantly with the increase of temperature and fuel consumption. Under severe accident conditions, the lower thermal conductivity can lead to the fuel’s center temperature so high that the core can melt, and then radionuclides will be released to the external environment. U3Si2 is considered as an accident resistant alternative fuel for UO2 though it has higher thermal conductivity and uranium density than UO2. However, U3Si2 fuel will produce a large number of point defects during irradiation. These defects tend to cluster and form voids or bubbles, causing fuel swelling through evolution. Continuous swelling of fuel will further affect the service life and the performance of fuel. Due to the service environment of U3Si2 fuel is extremely harsh and the experimental research cycle is long, the research cost is higher. It is very difficult to study the irradiation swelling of U3Si2 fuel through existing experimental methods, leading to lacking sufficient understanding of the evolution mechanism about its irradiation damage microstructure. Considering this situation, it is necessary to study the structure and performance of U3Si2 fuel by computer simulation. The first-principles, molecular dynamics and Monte Carlo methods have made significant contributions to the calculation of defect parameters, migration, and diffusion in U3Si2 fuel. Unfortunately, these methods ignore the spatial correlation between various microstructure features and evolution processes. Phase field simulation can consider the inhomogeneity of local microstructure at larger spatial and temporal scales, and more accurately simulate the evolution of voids under irradiation conditions. In this work, the phase-field method was used to simulate the void evolution of U3Si2 fuel in three-dimensional space, and the effect of fission density on the void evolution of U3Si2 was obtained. The results show that the size of void changes with the fission density in a power-law manner and satisfies the following equation 〈R〉∝FzD, z=0.45. Its size distribution is lognormal, independent of fission density. In the selected range of fission density, the average size of void increases with the fission density increase, which is approximately in the range of 2.20 nm. The number of vacancies, porosity, swelling and fission density are positively correlated, while the void concentration slowly decreases to a stable value after it rapidly increasing with fission density. The number of vacancies varies roughly from 102 to 106 during simulation. When the fission density is 14×1020 cm-3, the void concentration is about 1.6×1016 cm-3, porosity is about 0.1, and the swelling of fuel volume shall not exceed 3%. The simulation results are basically consistent with the experimental values.

     

/

返回文章
返回