• Acta Optica Sinica
  • Vol. 39, Issue 7, 0730001 (2019)
Xiao Hu1, Ruimei Wu2, Xiaoyu Zhu3, Peng Liu2..., Aihua Xiong2, Junshi Huang2, Puxiang Yang4, Junfei Xiong2 and Shirong Ai1,2,*|Show fewer author(s)
Author Affiliations
  • 1 School of Computer and Information Engineering, Jiangxi Agricultural University, Nanchang, Jiangxi 330045, China
  • 2 School of Engineering, Jiangxi Agricultural University, Nanchang, Jiangxi 330045, China
  • 3 School of Food Science and Engineering, Jiang Xi Agricultural University, Nanchang, Jiangxi 330045, China
  • 4 Jiangxi Sericulture and Tea Research Institute, Nanchang, Jiangxi 330043, China
  • show less
    DOI: 10.3788/AOS201939.0730001 Cite this Article Set citation alerts
    Xiao Hu, Ruimei Wu, Xiaoyu Zhu, Peng Liu, Aihua Xiong, Junshi Huang, Puxiang Yang, Junfei Xiong, Shirong Ai. Fast Detection of Chlorpyrifos Residues in Tea via Surface-Enhanced Raman Spectroscopy Combined with Two-Dimensional Correlation Spectroscopy[J]. Acta Optica Sinica, 2019, 39(7): 0730001 Copy Citation Text show less
    Comparison of Raman spectra of Chlorpyrifos. (a) SERS of 10-mg/L chlorpyrifos standard solution; (b) theoretical Raman spectrum of chlorpyrifos
    Fig. 1. Comparison of Raman spectra of Chlorpyrifos. (a) SERS of 10-mg/L chlorpyrifos standard solution; (b) theoretical Raman spectrum of chlorpyrifos
    Raman spectra of tea samples. (a) Original spectra; (b) spectra after SNV pre-treatment
    Fig. 2. Raman spectra of tea samples. (a) Original spectra; (b) spectra after SNV pre-treatment
    Two-dimensional correlation spectra of chlorpyrifos residues in tea samples at different bands. (a) Synchronization spectra; (b) autocorrelation spectra
    Fig. 3. Two-dimensional correlation spectra of chlorpyrifos residues in tea samples at different bands. (a) Synchronization spectra; (b) autocorrelation spectra
    Characteristic peaks of chlorpyrifos pesticide residues in tea
    Fig. 4. Characteristic peaks of chlorpyrifos pesticide residues in tea
    RMSECV of corresponding SVM model built with different principal components
    Fig. 5. RMSECV of corresponding SVM model built with different principal components
    Iteration curve of GWO
    Fig. 6. Iteration curve of GWO
    Scatter plots of predicted and measured values of model. (a) Calibration set; (b) prediction set
    Fig. 7. Scatter plots of predicted and measured values of model. (a) Calibration set; (b) prediction set
    Mass concentration /(mg·L-1)NumberInterval mass fraction /10-6
    01
    5-102-60.83
    11-207-260.50
    21-3027-670.24
    31-4068-930.38
    41-5094-1001.43
    Table 1. Preparation of tea samples with chlorpyrifos pesticide residue
    Theoretical
    wavenumber /cm-1
    Experimental
    wavenumber /cm-1
    Assignment
    434450v(Cl—H)
    524524v(P—O)
    570560v(P S)+v(C—CL)
    604-vbreathe
    674668vring
    752760v(P—O—C)
    814824v(P—O—C)
    846846v(C—Cl)
    936936v(P—O—C)
    -972v(P—O—C)
    10801096δ(C-H)ip
    -1164vring
    -1268vring
    13221322vring
    13521352v(C-N)
    14161420δ(C-H)ip
    -1494vring
    15381538v(C-N)
    15681566v(C C)
    1610-v(C C)
    Abbreviations: v-stretching; δ-deformation; ip-in plane bending
    Table 2. Theoretical and experimental SERS spectra of chlorpyrifos
    ModelVariable selected methodVariablesPCsCalibrationPrediction
    R2cRMSECR2pRESEPRPD
    PLS1096 cm-1110.547.280.615.401.54
    Full70180.971.760.941.914.19
    2DCOS1540.962.060.961.625.13
    SVM1096 cm-1110.577.300.664.801.73
    Full701150.971.940.942.233.58
    2DCOS1560.981.440.981.326.32
    Table 3. Performance of different models
    SampleTrue mass fraction /10-6Predicted mass fraction /10-6Recovery /%Relative deviation /%
    14.234.49106.156.15
    213.7914.33103.923.92
    322.3421.8197.63-2.37
    434.5333.9998.44-1.56
    545.1243.8397.14-2.86
    Table 4. Predicted and measured values of chlorpyrifos residue in tea based on SVM model
    Xiao Hu, Ruimei Wu, Xiaoyu Zhu, Peng Liu, Aihua Xiong, Junshi Huang, Puxiang Yang, Junfei Xiong, Shirong Ai. Fast Detection of Chlorpyrifos Residues in Tea via Surface-Enhanced Raman Spectroscopy Combined with Two-Dimensional Correlation Spectroscopy[J]. Acta Optica Sinica, 2019, 39(7): 0730001
    Download Citation