WO2020186844A1 - Self-adaptive surface absorption spectrum analysis method and system, storage medium, and device - Google Patents
Self-adaptive surface absorption spectrum analysis method and system, storage medium, and device Download PDFInfo
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- WO2020186844A1 WO2020186844A1 PCT/CN2019/125394 CN2019125394W WO2020186844A1 WO 2020186844 A1 WO2020186844 A1 WO 2020186844A1 CN 2019125394 W CN2019125394 W CN 2019125394W WO 2020186844 A1 WO2020186844 A1 WO 2020186844A1
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- G01N21/00—Investigating or analysing materials by the use of optical means, i.e. using sub-millimetre waves, infrared, visible or ultraviolet light
- G01N21/17—Systems in which incident light is modified in accordance with the properties of the material investigated
- G01N21/25—Colour; Spectral properties, i.e. comparison of effect of material on the light at two or more different wavelengths or wavelength bands
- G01N21/31—Investigating relative effect of material at wavelengths characteristic of specific elements or molecules, e.g. atomic absorption spectrometry
- G01N21/3103—Atomic absorption analysis
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- the present invention relates to the field of spectrum analysis, in particular to an adaptive surface absorption spectrum analysis method.
- Surface absorption spectroscopy detection is a non-destructive spectroscopic analysis technology that uses a wide-band light source to illuminate the surface of the sample, detect the reflected light from the surface of the sample, and determine the content of certain characteristic molecular groups in the sample by the absorption of incident light by the surface material. Because it does not need to destroy the sample morphology and structure, and the detection speed is fast, it is widely used in the field of industrial non-destructive testing. In recent years, it has also shown a good momentum of development in the field of medical in vitro non-destructive diagnosis.
- the traditional surface absorption spectroscopy analysis method needs to use a sample that does not contain the characteristic substance or characteristic molecular group to be measured as a reference object, measure the surface reflectance spectrum of the reference object as a blank light, and then place the sample in the same relative position to measure its surface reflectance spectrum After dividing by the blank light, it is converted into a reflectance or absorbance curve for qualitative and quantitative analysis.
- the disadvantage is that the change of the relative position between the sample and the optical probe of the instrument will easily have a greater impact on the measured characteristic peak intensity, and the interference of the absorption band before and after the wavelength position of the characteristic peak cannot be ruled out, making the detection result easy to appear Misjudgment affects the convenience and accuracy of detection.
- the present invention provides an adaptive surface absorption spectroscopy analysis method.
- the method uses the characteristics of a wide-band light source with continuous and gentle light intensity bands and slow changes in substrate absorption bands, and avoids potential problems after collecting sample surface reflection spectra.
- Narrowband absorption peak position using two light intensity bands at a certain distance before and after the potential narrowband absorption peak position to fit and restore a light intensity curve without narrowband absorption as a blank spectrum, and then divide the sample surface reflectance spectrum curve and the blank spectrum curve Logarithm to obtain the surface absorption spectrum curve of the sample.
- the present invention provides an adaptive surface absorption spectrum analysis method, which includes the following steps:
- Blank spectrum extraction selecting part of the spectrum data in the reflection spectrum data, and extracting the currently detected blank spectrum by performing data processing on the part of the spectrum data; wherein the part of the spectrum data does not include potential absorption peak data;
- step S2 further includes the following steps:
- step S24 is further included:
- the method further includes:
- the measured light intensity signal value is a value obtained after smoothing and noise reduction processing.
- step S1 further includes: irradiating the surface of the sample with a wide-band light source, and obtaining the reflection absorption spectrum of the sample surface with a spectrometer, and the intensity of the reflected light on the sample surface is greater than or equal to 5% of the full range of the spectrometer.
- An electronic device including: a processor;
- a memory and a program, wherein the program is stored in the memory and is configured to be executed by a processor, the program including an adaptive surface absorption spectroscopy analysis method.
- a computer-readable storage medium has a computer program stored thereon, and the computer program is executed by a processor by an adaptive surface absorption spectrum analysis method.
- the self-adaptive surface absorption spectrum analysis system includes a spectrum data acquisition module, an absorption spectrum calculation module and a blank spectrum extraction module; among them,
- the acquiring spectrum data module is used to acquire the reflection absorption spectrum of the surface of the sample to obtain reflection spectrum data; wherein the reflection absorption spectrum is a spectrum diagram with wavelength as the abscissa and light intensity signal value as the ordinate;
- the blank spectrum extraction module is used to select part of the spectrum data in the reflectance spectrum data, and extract the blank spectrum detected once by performing data processing on the part of the spectrum data; wherein the part of the spectrum data does not include potential absorption peak data ;
- the blank spectrum extraction module includes a selection spectrum collection unit, a calculation unit, and a blank spectrum fitting unit; the selection spectrum collection unit is used to select a section of spectrum bands at the wavelength intervals before and after the potential absorption peak in the reflection spectrum data, Forming a discrete combined spectrum set; the calculation unit is used to calculate the discrete combined spectrum set through the establishment function to obtain an approximation function expression;
- the absorption spectrum calculation module is used to perform a logarithmic operation on the quotient of the measured light intensity signal value of the wavelength point and the blank light intensity signal value obtained by using the blank spectrum and invert to obtain the absorbance value of the wavelength point.
- the calculation unit includes a model residual sorting unit, a unit for establishing the optimal approximation condition equation group, and an approximation function solving unit; wherein,
- the model residual arranging unit is used to establish an approximation function with the wavelength of a discrete point as the abscissa and the light intensity signal value as the ordinate, and the light intensity signal value obtained by the approximation function corresponds to the actual measured light intensity corresponding to the same discrete point
- the function expression of the difference obtained from the signal value is recorded as the residual expression
- the unit for establishing the best approximation condition equation group is used to perform arithmetic conversion on the residual expression according to the best approximation evaluation method to obtain the best approximation condition equation group;
- the approximation function solving unit is used to calculate all the coefficient parameters of the approximation function according to the optimal approximation condition equation set, and the coefficient parameters of the approximation function obtain the approximation function expression;
- the selected spectrum set unit includes a spectrum set processing unit, and the spectrum set processing unit is used to perform smoothing and noise reduction processing on the spectrum set by using an algorithm.
- the present invention has the following beneficial effects:
- the self-adaptive surface absorption spectrum analysis method only needs to collect the sample surface reflectance spectrum once during the measurement process. It is not necessary to collect the reflected light of the reference object as a blank spectrum before the measurement, because the blank spectrum used in the calculation is reflected from the sample surface
- the spectrum curve is extracted synchronously and in real time, so this method can eliminate the influence of the relative position change of the sample and the optical probe of the instrument, and adapt to the change of the distance between the sample and the optical probe within a certain range. Since the fitted blank spectrum curve contains the same substrate absorption band as the sample surface absorption spectrum, this method can eliminate the quantitative error caused by the superposition of substrate absorption.
- this method adapts to the change of the distance between the sample and the optical probe and the difference of the matrix composition of different samples, and achieves a more accurate quantitative analysis of the narrow-band characteristic absorption peaks in the sample.
- Figure 1 is a flowchart of the adaptive surface absorption spectroscopy analysis method of the present invention
- Figure 2 is a specific flow chart of the adaptive surface absorption spectrum analysis method of the present invention.
- Figure 3(a) is the three reflectance spectra of the surface layer of a gemstone detected by the traditional analysis method
- Figure 3(b) is the three absorption spectra of the surface layer of a gemstone detected by the traditional analysis method
- Figure 4 (a) is the three reflection spectra of the surface layer of a gemstone detected by the spectral analysis method of the present invention
- Figure 4(b) is the three absorption spectra of the surface layer of a certain gemstone detected by the spectral analysis method of the present invention.
- Figure 5 is a schematic diagram of the adaptive surface absorption spectrum analysis system of the present invention.
- the adaptive surface absorption spectrum analysis method includes the following steps:
- the reflectance spectrum data includes wavelength and light intensity signal values
- a broad-band light source is used to illuminate the sample surface
- a spectrometer collects the sample surface Reflective absorption spectrum to obtain a sample surface reflection spectrum including potential absorption peaks with wavelength as the abscissa and light intensity AD as the ordinate, where the light intensity AD value is the signal value output by the light intensity through AD conversion, hereinafter referred to as Light intensity AD value.
- Illuminate the surface of the sample with a broad-band light source collect the reflection and absorption spectrum of the sample surface with a spectrometer, and obtain a sample surface reflection spectrum with wavelength as the abscissa and light intensity AD as the ordinate, that is, the surface reflection spectrum in step S21 As shown in the figure, the reflected light intensity of the sample surface can reach more than 5% of the full range of the spectrometer.
- the distance between the sample surface and the optical probe of the spectrometer is not limited. Each collection can change the sample surface and the spectrometer optics. The distance between the probes, because the blank spectrum used in the calculation is synchronously and real-time extracted from the sample surface reflectance spectrum curve, which can eliminate the influence of the relative position change of the sample and the optical probe of the instrument, and it can adapt to the sample and the sample within a certain range. The change in distance between optical probes.
- step S2 further includes the following steps:
- S21 Select a spectrum set.
- the potential absorption peak refers to the current target wavelength range for narrowband absorption peak analysis.
- potential is mainly because there may or may not be a narrowband absorption peak in this wavelength band.
- the model function is A function expression using wavelength as an independent variable to approximate the aforementioned discrete spectral data points, that is, multiple data points with discrete wavelength as the abscissa and light intensity AD as the ordinate, and the wavelength of each discrete point is substituted into the function expression Subtract the measured light intensity AD value corresponding to the wavelength from the formula, where the measured light intensity AD value is the new value after smoothing, the difference obtained is the residual at this point, and the functional expression of the difference is the residual Difference expression.
- the model function used in the present invention is one of the commonly used Lagrange polynomials, Hermite polynomials, spline functions, Fourier series, etc., and is not limited to a specific function.
- step S24 further steps are included:
- Blank spectrum fitting According to the approximation function expression, bring all wavelengths including potential absorption peaks into the approximation function expression to calculate the corresponding light intensity signal value, and combine all the obtained light intensity signal values to obtain the blank spectrum Graph.
- the blank spectrum fitting is to calculate the fitted light intensity of all wavelength points through the previously solved best approximation function expression, that is, the wavelength value is substituted into the expression to calculate the corresponding AD value, including the potential peak position That is to say, all wavelength points including the target wavelength band of the current narrowband absorption spectrum peak analysis are calculated, and a new spectrum curve is obtained by fitting. This new spectrum curve is used as a blank spectrum to participate in the subsequent calculation of the absorption spectrum.
- Absorption spectrum analysis processing performing a logarithmic operation on the quotient of the measured light intensity signal value of the wavelength point and the blank light intensity signal value extracted by using the blank spectrum and inverting the absorbance value of the wavelength point.
- the measured light intensity AD value of each wavelength point is divided by the fitted blank light intensity AD value of the point, the quotient is logarithmically calculated and then the inverse is multiplied by minus 1 to obtain the absorbance value of the point,
- the curve formed by wavelength as the abscissa and absorbance as the ordinate is the absorption spectrum.
- the calculation method of the absorption spectrum in this embodiment is the same as the traditional analysis method, that is, both the measured light intensity and the blank light intensity are punished and logarithmic calculations.
- the difference lies in the blank light intensity used in the present invention. It is synchronously extracted from the sample reflectance spectrum curve in real time, and its overall intensity changes synchronously with the reflected light from the sample surface, which can eliminate the interference of positional changes and matrix differences, and obtain a more stable and accurate narrow-band characteristic absorption spectrum, providing qualitative and quantitative Accuracy.
- step S21 further steps are included:
- the algorithm used for spectral set smoothing and noise reduction processing can be simple multi-point averaging or complex moving window smoothing. It is not limited to a specific algorithm.
- the spectral set smoothing noise reduction processing reduces noise Interference is that the measured light intensity AD value is more accurate.
- An electronic device comprising: a processor; a memory; and a program, wherein the program is stored in the memory and is configured to be executed by the processor, and the program includes a method for performing an adaptive surface absorption spectroscopy analysis method .
- a computer-readable storage medium has a computer program stored thereon, and the computer program is executed by a processor by an adaptive surface absorption spectrum analysis method.
- the adaptive surface absorption spectrum analysis system includes a spectrum data acquisition module, an absorption spectrum calculation module and a blank spectrum extraction module; among them,
- the acquiring spectrum data module is used to acquire the reflection absorption spectrum of the surface of the sample to obtain reflection spectrum data; wherein the reflection absorption spectrum is a spectrum diagram with wavelength as the abscissa and light intensity signal value as the ordinate;
- the blank spectrum extraction module is used to select part of the spectrum data in the reflectance spectrum data, and extract the blank spectrum detected once by performing data processing on the part of the spectrum data; wherein, the part of the spectrum data does not include potential absorption peak data ;
- the blank spectrum extraction module includes a selection spectrum collection unit, a calculation unit, and a blank spectrum fitting unit; the selection spectrum collection unit is used to select a section of spectrum bands at the wavelength intervals before and after the potential absorption peak in the reflection spectrum data, Forming a discrete combined spectrum set; the calculation unit is used to calculate the discrete combined spectrum set through the establishment function to obtain an approximation function expression;
- the absorption spectrum calculation module is used to perform a logarithmic operation on the quotient of the measured light intensity signal value of the wavelength point and the blank light intensity signal value obtained by using the blank spectrum and invert to obtain the absorbance value of the wavelength point.
- the calculation unit includes a model residual sorting unit, a unit for establishing the optimal approximation condition equation group, and an approximation function solving unit;
- the model residual arranging unit is used to establish an approximation function with the wavelength of a discrete point as the abscissa and the light intensity signal value as the ordinate, and the light intensity signal value obtained by the approximation function corresponds to the actual measured light intensity corresponding to the same discrete point
- the function expression of the difference obtained from the signal value is recorded as the residual expression
- the unit for establishing the best approximation condition equation group is used to perform arithmetic conversion on the residual expression according to the best approximation evaluation method to obtain the best approximation condition equation group;
- the approximation function solving unit is used to calculate all the coefficient parameters of the approximation function according to the optimal approximation condition equation set, and the coefficient parameters of the approximation function obtain the approximation function expression;
- the selected spectrum set unit includes a spectrum set processing unit, and the spectrum set processing unit is used to perform smoothing and noise reduction processing on the spectrum set by using an algorithm.
- Figure 3(a) and Figure 3(b) are the analysis results of the traditional analysis method.
- the thicker smooth curve 10 in Figure 3(a) is the blank spectrum measured by using the PTFE whiteboard reference material.
- the surface absorption spectrum analysis of the reflection spectrum of the gemstone in the second detection uses the gray spectrum as the blank spectrum. After triggering and logarithmic operation, three absorption spectrum curves as shown in Figure 3(b) are obtained.
- the peak absorbances of the three narrow-band absorption peaks are 0.049, 0.107, and 0.204, respectively, and the peak absorbance values are very different; 3 absorptions
- the peak-to-valley difference in absorbance of the narrow-band characteristic absorption peak in the spectrum is 0.050, 0.053, and 0.057, respectively. Even if the intensity of the narrow-band characteristic absorption peak is calculated according to the peak-to-valley difference, the average error of the three measurements is greater than 6.8%.
- Figure 4 (a) and Figure 4 (b) are the analysis results of the analysis method of the present invention.
- the three thicker smooth curves 201, 202 and 203 in Figure 4 (a) are synchronized in real time from three gem reflection spectra. Fit the extracted 3 blank spectra, use the reflectance spectra detected three times and the blank spectra extracted simultaneously in real time to calculate the absorbance, and obtain the 3 absorption spectrum curves shown in Figure 4(b), which can be seen from the figure
- the three absorption spectrum curves are highly coincident, and their peak absorbances are 0.064, 0.063, and 0.061, respectively, and the average error of the three measurements is less than 2.7%.
- this method can eliminate the interference of positional distance changes and matrix differences, and get more Stable and accurate narrow-band characteristic absorption spectrum improves qualitative and quantitative accuracy.
- the method of the present invention only needs to collect the surface reflectance spectrum of the sample once during the measurement process, and it is not necessary to collect the reflected light of the reference object as the blank spectrum before the measurement, because the blank spectrum used in the calculation is from the surface reflectance curve of the sample Synchronous real-time extraction, so the method of the present invention can eliminate the influence of the relative position change of the sample and the optical probe of the instrument, and adapt to the change of the distance between the sample and the optical probe within a certain range.
- the method of the present invention can eliminate the quantitative error caused by the superposition of substrate absorption.
- the method of the present invention adapts to the change of the distance between the sample and the optical probe and the difference of the matrix composition of different samples, and realizes more accurate quantification of the narrow-band characteristic absorption peaks in the sample. analysis.
Abstract
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Claims (10)
- 自适应表面吸收光谱分析方法,其特征在于,包括如下步骤:The adaptive surface absorption spectrum analysis method is characterized in that it comprises the following steps:S1、获取光谱数据,获取样品表层的反射光谱数据;其中,所述反射光谱数据包括波长与光强信号值;S1. Obtain spectrum data, and obtain reflectance spectrum data of the sample surface; wherein, the reflectance spectrum data includes wavelength and light intensity signal values;S2、空白光谱提取,选取反射光谱数据中的部分光谱数据,通过对所述部分光谱数据进行数据处理,提取得到当前检测的空白光谱;其中,所述部分光谱数据不包括潜在吸收峰数据;S2. Blank spectrum extraction, selecting part of the spectrum data in the reflection spectrum data, and extracting the currently detected blank spectrum by performing data processing on the part of the spectrum data; wherein the part of the spectrum data does not include potential absorption peak data;S3、吸收光谱分析处理,将所述波长点的实测光强信号值与利用空白光谱提取得到的空白光强信号值的商进行对数运算并取反得到所述波长点的吸光度值。S3. Absorption spectrum analysis processing, performing a logarithmic operation on the quotient of the measured light intensity signal value of the wavelength point and the blank light intensity signal value extracted by using the blank spectrum and inverting the absorbance value of the wavelength point.
- 如权利要求1所述的自适应表面吸收光谱分析方法,其特征在于,在步骤S2中还包括如下步骤:The adaptive surface absorption spectroscopy analysis method of claim 1, wherein step S2 further comprises the following steps:S21、选取光谱集,在所述反射光谱数据中位于潜在吸收峰前后波长间隔处各选取一段谱带,形成离散组合光谱集;S21. Select a spectrum set, and select a section of spectrum bands at the wavelength intervals before and after the potential absorption peak in the reflection spectrum data to form a discrete combined spectrum set;S22、模型残差整理,建立以离散点波长为横坐标、光强信号值为纵坐标的逼近函数,通过所述逼近函数得出的光强信号值与同一离散点对应的实测光强信号值的差值的函数表达式,记为残差表达式;S22. Organize the residuals of the model, establish an approximation function with the wavelength of the discrete point as the abscissa and the light intensity signal as the ordinate, and the light intensity signal value obtained by the approximation function is the actual measured light intensity signal value corresponding to the same discrete point The function expression of the difference of is recorded as the residual expression;S23、建立最佳逼近条件方程组,根据最佳逼近评价方法对所述残差表达式进行运算转换得到最佳逼近条件方程组;S23. Establish a best approximation condition equation group, and perform arithmetic conversion on the residual expression according to the best approximation evaluation method to obtain the best approximation condition equation group;S24、逼近函数求解,根据求解最佳逼近条件方程组计算出逼近函数的全部系数参数,由逼近函数的系数参数得出逼近函数表达式。S24. Solve the approximation function, calculate all the coefficient parameters of the approximation function according to the optimal approximation condition equation set, and obtain the approximation function expression from the coefficient parameters of the approximation function.
- 如权利要求2所述的自适应表面吸收光谱分析方法,其特征在于,在步骤S24之后还包括步骤:3. The adaptive surface absorption spectroscopy analysis method of claim 2, wherein after step S24, the method further comprises:S25、空白光谱拟合,根据逼近函数表达式将包括潜在吸收峰在内的全部波长带入逼近函数表达式计算得出相应的光强信号值,将得到的所有光强信 号值组合得到空白光谱曲线图。S25. Blank spectrum fitting. According to the approximation function expression, bring all wavelengths including potential absorption peaks into the approximation function expression to calculate the corresponding light intensity signal value, and combine all the obtained light intensity signal values to obtain the blank spectrum Graph.
- 如权利要求2所述的自适应表面吸收光谱分析方法,其特征在于,在步骤S21之后还包括步骤:The adaptive surface absorption spectroscopy analysis method according to claim 2, wherein after step S21, the method further comprises:S211、光谱集处理,利用算法对光谱集进行平滑降噪处理。S211, spectrum set processing, using an algorithm to perform smoothing and noise reduction processing on the spectrum set.
- 如权利要求1-4任一项所述的自适应表面吸收光谱分析方法,其特征在于,所述实测光强信号值为经过平滑降噪处理后取得的值。The adaptive surface absorption spectroscopy analysis method according to any one of claims 1 to 4, wherein the measured light intensity signal value is a value obtained after smoothing and noise reduction processing.
- 如权利要求1所述的自适应表面吸收光谱分析方法,其特征在于,在步骤S1中还包括,利用宽谱带光源照射样品表面、用光谱仪器获取样品表层的反射吸收光谱,样品表面的反射光的强度大于等于所述光谱仪器的满量程的5%。The self-adaptive surface absorption spectroscopy analysis method of claim 1, wherein step S1 further comprises: irradiating the surface of the sample with a broad-band light source, using a spectrometer to obtain the reflection absorption spectrum of the sample surface, and the reflection of the sample surface The intensity of the light is greater than or equal to 5% of the full scale of the spectrometer.
- 一种电子设备,其特征在于包括:处理器;An electronic device, characterized by comprising: a processor;存储器;以及程序,其中所述程序被存储在所述存储器中,并且被配置成由处理器执行,所述程序包括用于执行如权利要求1所述的方法。A memory; and a program, wherein the program is stored in the memory and is configured to be executed by a processor, and the program includes a method for performing the method according to claim 1.
- 一种计算机可读存储介质,其上存储有计算机程序,其特征在于:所述计算机程序被处理器执行如权利要求1所述的方法。A computer-readable storage medium having a computer program stored thereon, wherein the computer program is executed by a processor to execute the method according to claim 1.
- 自适应表面吸收光谱分析系统,其特征在于,包括获取光谱数据模块、吸收光谱计算模块和空白光谱提取模块;其中,The self-adaptive surface absorption spectrum analysis system is characterized by comprising a spectrum data acquisition module, an absorption spectrum calculation module and a blank spectrum extraction module; among them,所述获取光谱数据模块用于获取样品表层的反射吸收光谱,得到反射光谱数据;其中,所述反射吸收光谱为以波长为横坐标、光强信号值为纵坐标的光谱图;The acquiring spectrum data module is used to acquire the reflection absorption spectrum of the surface of the sample to obtain reflection spectrum data; wherein the reflection absorption spectrum is a spectrum diagram with wavelength as the abscissa and light intensity signal value as the ordinate;所述空白光谱提取模块用于选取反射光谱数据中的部分光谱数据,通过对所述部分光谱数据进行数据处理,提取得到一次检测的空白光谱;其中,所述部分光谱数据不包括潜在吸收峰数据;The blank spectrum extraction module is used to select part of the spectrum data in the reflectance spectrum data, and extract the blank spectrum detected once by performing data processing on the part of the spectrum data; wherein the part of the spectrum data does not include potential absorption peak data ;所述空白光谱提取模块包括选取光谱集单元、计算单元和空白光谱拟合单元;所述选取光谱集单元用于在所述反射光谱数据中位于潜在吸收峰前后波长间隔处各选取一段谱带,形成离散组合光谱集;所述计算单元用于将离 散组合光谱集通过建立函数计算后得到逼近函数表达式;The blank spectrum extraction module includes a selection spectrum collection unit, a calculation unit, and a blank spectrum fitting unit; the selection spectrum collection unit is used to select a section of spectrum bands at the wavelength intervals before and after the potential absorption peak in the reflection spectrum data, Forming a discrete combined spectrum set; the calculation unit is used to calculate the discrete combined spectrum set through the establishment function to obtain an approximation function expression;所述吸收光谱计算模块用于将波长点的实测光强信号值与利用空白光谱得到的空白光强信号值的商进行对数运算并取反得到该波长点的吸光度值。The absorption spectrum calculation module is used to perform a logarithmic operation on the quotient of the measured light intensity signal value of the wavelength point and the blank light intensity signal value obtained by using the blank spectrum and invert to obtain the absorbance value of the wavelength point.
- 如权利要求9所述的自适应表面吸收光谱分析系统,其特征在于,所述计算单元包括模型残差整理单元、建立最佳逼近条件方程组单元和逼近函数求解单元;其中,The adaptive surface absorption spectrum analysis system according to claim 9, wherein the calculation unit includes a model residual sorting unit, a unit for establishing an optimal approximation condition equation group, and an approximation function solving unit; wherein,所述模型残差整理单元用于建立以离散点波长为横坐标、光强信号值为纵坐标的逼近函数,通过所述逼近函数得出的光强信号值与同一离散点对应的实测光强信号值所得的差值的函数表达式,记为残差表达式;The model residual arranging unit is used to establish an approximation function with the wavelength of a discrete point as the abscissa and the light intensity signal value as the ordinate, and the light intensity signal value obtained by the approximation function corresponds to the actual measured light intensity corresponding to the same discrete point The function expression of the difference obtained from the signal value is recorded as the residual expression;所述建立最佳逼近条件方程组单元用于根据最佳逼近评价方法对所述残差表达式进行运算转换得到最佳逼近条件方程组;The unit for establishing the best approximation condition equation group is used to perform arithmetic conversion on the residual expression according to the best approximation evaluation method to obtain the best approximation condition equation group;所述近函数求解单元用于根据求解最佳逼近条件方程组计算出逼近函数的全部系数参数,逼近函数的系数参数得出逼近函数表达式;The approximation function solving unit is used to calculate all the coefficient parameters of the approximation function according to the optimal approximation condition equation set, and the coefficient parameters of the approximation function obtain the approximation function expression;所述选取光谱集单元包括光谱集处理单元,所述光谱集处理单元用于利用算法对光谱集进行平滑降噪处理。The selected spectrum set unit includes a spectrum set processing unit, and the spectrum set processing unit is used to perform smoothing and noise reduction processing on the spectrum set by using an algorithm.
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CN109991181B (en) * | 2019-03-19 | 2020-08-18 | 谱诉光电科技(苏州)有限公司 | Adaptive surface absorption spectrum analysis method, system, storage medium and device |
CN112782109B (en) * | 2021-01-27 | 2023-07-04 | 中国计量科学研究院 | Spectrum parameter acquisition method and device, electronic equipment and storage medium |
CN113889196B (en) * | 2021-12-07 | 2022-03-22 | 谱诉光电科技(苏州)有限公司 | Spectrogram analysis method and device for component detection and electronic equipment |
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