Calibration transfer of partial least squares jet fuel property models using a segmented virtual standards slope-bias correction method

Chemometrics and Intelligent Laboratory Systems

Volumn 110, Issue 1, 2012, Pages 64-73

  Abdelkader, Mohamed F ^a   Cooper, John B ^a   Larkin, Christopher M ^b  

^a OLD DOMINION UNIVERSITY   (United States)

^b Bruker Optics Inc   (United States)

Author keywords

Calibration transfer; Fuel; Multivariate; PDS; Piece wise direct standardization; Standardization; SVSSB; Virtual

Indexed keywords

AROMATIC COMPOUND; FUEL; HYDROGEN; JET FUEL; UNCLASSIFIED DRUG;

ANALYTICAL ERROR; ARTICLE; CALIBRATION; CETANE INDEX; CHEMICAL COMPOSITION; CHEMOMETRIC ANALYSIS; CONTROLLED STUDY; DENSITY; DISTILLATION; FLASHPOINT; FREEZING; GRAVITY; NEAR INFRARED SPECTROSCOPY; PARTIAL LEAST SQUARES REGRESSION; PHYSICAL CHEMISTRY; PHYSICAL PARAMETERS; PRIORITY JOURNAL; QUANTITATIVE ANALYSIS; STANDARDIZATION; STATISTICAL MODEL; TEMPERATURE SENSITIVITY; VISCOSITY;

EID: 83655201102     PISSN: 01697439     EISSN: 18733239     Source Type: Journal    
DOI: 10.1016/j.chemolab.2011.09.014     Document Type: Article

References (21)

1. Cooper J.B., Larkin C.M., Schmitigal J., Morris R.E., Abdelkader M.F. Rapid analysis of jet fuel using a handheld near-infrared (NIR) analyzer. Applied Spectroscopy 2011, 65:187-192.
2. Balabin R.M., Safieva R.Z., Lomakina E.I. Near-infrared (NIR) spectroscopy for motor oil classification: From discriminant analysis to support vector machines. Microchemical Journal 2011, 98:121-128.
3. Balabin R.M., Safieva R.Z. Biodiesel classification by base stock type (vegetable oil) using near infrared spectroscopy data. Analytica Chimica Acta 2011, 689:190-197.
4. Balabin R.M., Lomakina E.I., Safieva R.Z. Neural network (ANN) approach to biodiesel analysis: analysis of biodiesel density, kinematic viscosity, methanol and water contents using near infrared (NIR) spectroscopy. Fuel 2011, 90:2007-2015.
5. Pierna J.A.F., Vermeulen P., Lecler B., Baeten V., Dardenne P. Calibration transfer from dispersive instruments to handheld spectrometers. Applied Spectroscopy 2010, 64:644-648.
6. Pereira C.F., Pimentel M.F., Galvão R.K.H., Honorato F.A., Stragevitch L., Martins M.N. A comparative study of calibration transfer methods for determination of gasoline quality parameters in three different near infrared spectrometers. Analytica Chimica Acta 2008, 611:41-47.
7. Fernández-Ahumada E., Garrido-Varo A., Guerrero J.E., Pérez-Marín D., Fearn T. Taking NIR calibrations of feed compounds from the laboratory to the process: calibration transfer between predispersive and postdispersive instruments. Journal of Agricultural and Food Chemistry 2008, 56:10135-10141.
8. Sulub Y., Small G.W. Spectral simulation methodology for calibration transfer of near-infrared spectra. Applied Spectroscopy 2007, 61:406-413.
9. Wang Y., Veltkamp D.J., Kowalski B.R. Multivariate instrument standardization. Analytical Chemistry 1991, 63:2750-2756.
10. Bouveresse E., Massart D.L. Improvement of the piecewise direct standardisation procedure for the transfer of NIR spectra for multivariate calibration. Chemometrics and Intelligent Laboratory Systems 1996, 32:201-213.
11. Yee N.G., Coghill G.G. Factor selection strategies for orthogonal signal correction applied to calibration of near-infrared spectra. Chemometrics and Intelligent Laboratory Systems 2003, 67:145-156.
12. Bouveresse E., Hartmann C., Massart D.L., Last I.R., Prebble K.A. Standardization of near-infrared spectrometric instruments. Analytical Chemistry 1996, 68:982-990.
13. Digital filtering model updating methods for improving the robustness of near-infrared multivariate calibrations. Applied Spectroscopy 2009, 63:246-255.
14. Kunz M.R., Ottaway J., Kalivas J.H., Andries E. Impact of standardization sample design on Tikhonov regularization variants for spectroscopic calibration maintenance and transfer. Journal of Chemometrics 2010, 24:218-229.
15. S.M. Maggard, Spectroscopic instrument calibration in: U.S. Patent (Ed.) U.S. Patent Ashland Oil, Inc., U.S. Patent 5,243,546, 1993.
16. Cooper J.B., Larkin C.M., Abdelkader M.F. Virtual standard slope and bias calibration transfer of partial least squares jet fuel property models to multiple near infrared spectroscopy instruments. Journal of Near Infrared Spectroscopy 2011, 19:139-150.
17. Savitzky A., Golay M.J.E. Smoothing and differentiation of data by simplified least squares procedures. Analytical Chemistry 1964, 36:1627-1639.
18. Stewart M.G.K.a. Advanced Theory of Statistics 1977, 1. Charles Griffin and Company limited, london.
19. Edwards T. Jet Fuel Composition 2011, 21-26. CRC Press.
20. Steele D. Multivariate calibration: H. Martens and T. Naes. John Wiley and Sons. Spectrochimica Acta Part A: Molecular Spectroscopy 1990, 46. 1541-1541.
21. Weisberg S. Applied Linear Regression 1985, John Wiley & Sons, New York.