聚变堆中第一壁材料钨的紧束缚理论研究

Tight-binding Theory Study on the First Wall Material Tungsten in Fusion Reactor

  • 摘要: 为研究辐照时处于电子激发态下第一壁材料钨(W)的结构演化规律和热力学性质,采用紧束缚方法对聚变堆中W的物理性质进行理论研究。结果表明,体系在高能粒子辐照下诱导的电子激发导致了体系中被辐照的区域自发出现微孔、晶格急剧膨胀、熔点下降等现象。具体地,在中等电子温度(~5 000 K)以下,W的晶格膨胀主要由晶格温度驱动,但在电子温度较高时电子温度导致被辐照区域的晶格膨胀效应不可被忽略。特别是当电子温度很高(>10 000 K)时,即便晶格温度不高,电子温度也会导致很大程度晶格膨胀。这对认识聚变堆中第一壁材料W在服役过程中的物理状态十分重要。

     

    Abstract: In order to study the structural evolution and thermodynamic properties of the first wall material tungsten (W) in electronic excited state during irradiation, the physical properties of W in fusion reactors were studied theoretically by using tight-binding potential model. It is found that the electronic excitation induced by the irradiation of energetic particles leads to the events such as spontaneous appearance of micro-voids, sharp expansion of the lattice, and decrease in the melting point of the irradiated regions in W. Specifically, the lattice expansion of W is mainly driven by lattice temperature under the medium temperatures (~5 000 K). But the lattice expansion effect caused by electronic temperature cannot be ignored at the higher temperatures. Especially when the electronic temperature is rather high (>10 000 K), the electronic temperature will cause a large degree of lattice expansion, even if the lattice temperature is low for the irradiated regions. These findings bring benefit to gain deep understanding in the physical performance of W in fusion reactors during service.

     

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