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利用近红外光谱结合特征波长选择快速检测沼气浆中的挥发性脂肪酸。

Fast detection of volatile fatty acids in biogas slurry using NIR spectroscopy combined with feature wavelength selection.

机构信息

College of Electrical and Information, Northeast Agricultural University, Harbin 150030, China.

College of Information and Electrical Engineering, Heilongjiang Bayi Agricultural University, Daqing 163319, China.

出版信息

Sci Total Environ. 2023 Jan 20;857(Pt 1):159282. doi: 10.1016/j.scitotenv.2022.159282. Epub 2022 Oct 7.

Abstract

To analyze the state of anaerobic digestion (AD), fast detection models of volatile fatty acids (VFAs) were constructed using near-infrared transmission spectroscopy combined with partial least squares regression to measure concentrations of the acetic acid (AA), propionic acid (PA) and total acid (TA) in biogas slurry. CARS-SA-BPSO algorithm was proposed based on competitive adaptive reweighted sampling (CARS) and simulated annealing binary particle swarm optimization algorithm (SA-BPSO) for selecting feature wavelengths of the AA, PA and TA. Regression models were established with the determination coefficient of prediction (R) of 0.989, root mean squared error of prediction (RMSEP) of 0.111 and residual predictive deviation (RPD) of 9.706 for AA; R of 0.932, RMSEP of 0.116 and RPD of 3.799 for PA; R of 0.895, RMSEP of 0.689 and RPD of 3.676 for TA. It is sufficient to meet the fast detection needs of the AA and PA concentrations in biogas slurry, and basically meet the measuring demand of the TA concentration. CARS-SA-BPSO effectively improves the performance of the calibration model using sensitive wavelength selections, which provides theoretical support for establishing the spectral quantitative regression model to meet the requirements of practical application.

摘要

为分析厌氧消化(AD)状态,采用近红外透射光谱结合偏最小二乘回归构建了挥发性脂肪酸(VFAs)快速检测模型,以测量沼气浆中乙酸(AA)、丙酸(PA)和总酸(TA)的浓度。基于竞争自适应重加权采样(CARS)和模拟退火二进制粒子群优化算法(SA-BPSO)提出了 CARS-SA-BPSO 算法,用于选择 AA、PA 和 TA 的特征波长。建立了回归模型,AA 的预测决定系数(R)为 0.989,预测均方根误差(RMSEP)为 0.111,预测偏差率(RPD)为 9.706;PA 的 R 为 0.932,RMSEP 为 0.116,RPD 为 3.799;TA 的 R 为 0.895,RMSEP 为 0.689,RPD 为 3.676。足以满足沼气浆中 AA 和 PA 浓度的快速检测需求,基本满足 TA 浓度的测量要求。CARS-SA-BPSO 有效地通过敏感波长选择提高了校准模型的性能,为建立满足实际应用要求的光谱定量回归模型提供了理论支持。

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