Zhou Gang, Tian Ye, Xue Shuai, Zhou Guangqi, Song Ci, Zhou Lin, Tie Guipeng, Shi Feng, Shen Yongxiang, Zhu Zhe
College of Intelligence Science and Technology, National University of Defense Technology, 109 Deya Road, Changsha 410073, Hunan, China.
Hunan Key Laboratory of Ultra-Precision Machining Technology, Changsha 410073, Hunan, China.
Materials (Basel). 2020 Sep 19;13(18):4172. doi: 10.3390/ma13184172.
Various defects during the manufacture of a high-energy laser monocrystalline silicon reflector will increase the energy absorption rate of the substrate and worsen the optical properties. Micron-scale or larger manufacturing defects have been inhibited by mechanism study and improvement in technology, but the substrate performance still fails to satisfy the application demand. We focus on the changes in the optical properties affected by nanoscale and Angstrom lattice defects on the surface of monocrystalline silicon and acquire the expected high reflectivity and low absorptivity through deterministic control of its defect state. Based on the first principles, the band structures and optical properties of two typical defect models of monocrystalline silicon-namely, atomic vacancy and lattice dislocation-were analyzed by molecular dynamics simulations. The results showed that the reflectivity of the vacancy defect was higher than that of the dislocation defect, and elevating the proportion of the vacancy defect could improve the performance of the monocrystalline silicon in infrared (IR) band. To verify the results of simulations, the combined Ion Beam Figuring (IBF) and Chemical Mechanical Polishing (CMP) technologies were applied to introduce the vacancy defect and reduce the thickness of defect layer. After the process, the reflectivity of the monocrystalline silicon element increased by 5% in the visible light band and by 12% in the IR band. Finally, in the photothermal absorption test at 1064 nm, the photothermal absorption of the element was reduced by 80.5%. Intense laser usability on the monocrystalline silicon surface was achieved, and the effectiveness and feasibility of deterministic regulation of optical properties were verified. This concept will be widely applied in future high-energy laser system and X-ray reflectors.
高能激光单晶硅反射镜制造过程中的各种缺陷会提高基底的能量吸收率并恶化光学性能。微米级及以上的制造缺陷已通过机理研究和技术改进得到抑制,但基底性能仍无法满足应用需求。我们聚焦于单晶硅表面纳米级和埃级晶格缺陷对光学性能的影响,并通过对其缺陷状态的确定性控制获得了预期的高反射率和低吸收率。基于第一性原理,通过分子动力学模拟分析了单晶硅的两种典型缺陷模型——原子空位和晶格位错的能带结构和光学性能。结果表明,空位缺陷的反射率高于位错缺陷,提高空位缺陷的比例可以改善单晶硅在红外(IR)波段的性能。为了验证模拟结果,采用离子束修形(IBF)和化学机械抛光(CMP)相结合的技术引入空位缺陷并减小缺陷层厚度。处理后,单晶硅元件在可见光波段的反射率提高了5%,在红外波段提高了12%。最后,在1064nm的光热吸收测试中,该元件的光热吸收降低了80.5%。实现了强激光在单晶硅表面的可用性,验证了光学性能确定性调控的有效性和可行性。这一概念将在未来的高能激光系统和X射线反射镜中得到广泛应用。