作者单位
摘要
江南大学轻工过程先进控制教育部重点实验室, 江苏 无锡 214122
利用拉曼光谱进行混合物组分定量分析一直是分析化学领域的一大难题。 针对现有的基于机器学习(如支持向量回归机、 偏最小二乘)的混合物定量分析方法存在的训练样本难以获得、 模型推广性能差的问题, 提出了一种基于拉曼光谱谱峰强度最小二乘拟合的已知混合物组分直接定量分析方法。 该方法首先采集已知混合物及其各组分的拉曼光谱, 利用连续小波变换和惩罚最小二乘法相结合的方法对采集的拉曼光谱进行去噪、 基线校正等预处理。 通过斜率比较法将预处理后的拉曼光谱分为多个光谱子区间, 将各子区间的拉曼光谱看作是多个Voigt函数的线性叠加, 并利用levenberg-marquardt-fletcher(LMF)算法求解获得各谱峰的位置、 强度、 半高宽等表达系数。 根据各组分参考光谱的谱峰位置, 确定各组分对混合物光谱中每个谱峰的贡献度。 依据朗伯-比尔定律中拉曼光谱的谱峰峰强与其所对应的浓度的正比关系, 建立超定方程; 最后利用最小二乘法拟合该超定方程得到各组分对应的系数, 从而获得各组分的体积浓度。 利用乙醇、 乙腈、 丙酮、 环己烷、 二丙酮醇、 丙二酸二乙酯六种组分配置了10种三元混合物(每种三元混合物9个体积浓度比), 采集了90组混合物及6种组分的拉曼光谱数据。 在混合物及其组分参考光谱测量条件(功率和积分时间)相同情况下, 所有组分的相关系数(r)均在0.96以上, 均方根误差(RMSE)小于6%, 剩余预测偏差(RPD)均大于2.5; 在混合物及其组分参考光谱在不同测量条件下, 各组分的r均大于0.93, 最大RMSE为7.94%, RPD均大于2.0, 证明了算法具有良好的准确性和鲁棒性。 所提出的方法能够实现对三组分混合物的快速、 准确的直接定量分析, 为混合物的定量分析提供了一种有效的途径。
拉曼光谱 混合物组分 定量分析 拉曼谱峰强度 Voigt函数 Raman spectroscopy Mixture component Quantitative analysis Intensity of Raman spectral peak Voigt function 
光谱学与光谱分析
2020, 40(11): 3599
Author Affiliations
Abstract
1 中国科学院上海光学精密机械研究所, 高功率激光物理重点实验室, 上海201800
2 中国科学院大学, 北京100049
Large aperture high-power laser drivers usually focus the high power laser beams in 2×2 quads to the target chamber center in order to increase the light intensity on the target plane. The large aperture wedged focus lenses are the core components in the focus system of quadruplets of beams, and it is thought possible to use four two-dimensional off-axis wedged focus lenses as four sub-lenses to make up a larger aperture wedged focus lens in form to focus the four beams. Given that the large aperture two-dimensional off-axis wedged focus lenses are processed and used difficultly, the wedged focus lenses are divided into three categories: the two-dimensional off-axis wedged focus lenses, the onedimensional off-axis wedged focus lenses, and the non-off-axis wedged focus lenses. On the basis of the three modes of the wedged focus lenses and the corresponding specific incidence angles of each sub-beam, the three focus schemes for the 2×2 beam array are put forward to comparatively research the light intensity distribution on the target plane. Research results show that from a perspective of the coherence among the four sub-beams, the phase factors of each sub-beam respectively introducing by the three focus systems with the two-dimensional off-axis, one-dimensional off-axis, and non-off-axis wedged focus lenses are asymmetric, asymmetric and symmetric inside each sub-beam, and symmetric, asymmetric and symmetric among the four sub-beams. Therefore, the wave front consistency of the four sub-beams decreases in the order of the focus systems with the non-off-axis, two-dimensional off-axis, and one-dimensional off-axis wedged focus lenses. The focus schemes with the non-off-axis wedged focus lenses for 2×2 beam array can get the narrowest main-lobe, the strongest peak-value intensity, the highest energy concentration ratio on the target plane, followed by the one-dimensional off-axis and two-dimensional off-axis wedged focus lenses. The off-axis mode of the wedged focus lenses not only increases the complexity in the course of processing and using, but also increases the main-lobe size, decreases the peak-value intensity and the energy concentration ratio, which obtains a weaker focusing characteristics than that of the non-off-axis mode of the wedged focus lenses. Research results can provide an important reference for the design of the focus system in the target area of high-power laser drivers.
集束聚焦 楔形透镜 光强分布 beam array focus wedged focus lens light intensity distribution 
Collection Of theses on high power laser and plasma physics
2016, 14(1): 064203
Author Affiliations
Abstract
1 中国科学院上海光学精密机械研究所, 高功率激光物理国家实验室, 上海201800
2 中国科学院大学, 北京100049
Based on the optical transmission theory, the reason why front-surface particle contamination may induce the original damage of thin optical components is considered, and a damage mechanism is put forward: The localized thermal deformation of an optical element induced by the thermal effect of particle contamination together with the shading effect of it can disturb the laser beams. Simulated results show that for a high power laser, the localized thermal deformation of thin optical components, which disturbs the laser beam, is an important cause to produce strong light intensity modulations. The surface shape, phase delay, and thermal diffusion length of a localized thermal deformation are constantly changing with the increase of laser pulse shot number, so the highest light intensity modulation will be produced at different positions in the thickness direction or the xy direction on the rear-surface of an optical element. This not only can easily induce some damages on the rear-surface of the optical element, but also cause the interior damages scattered in the thickness direction.
激光损伤 光传输 颗粒污染物 热变形 laser damage optical transmission particle contamination thermal deformation 
Collection Of theses on high power laser and plasma physics
2014, 12(1): 134201

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