Resolution of overlapping mid-infrared spectra using SIMPLISMA and a second-order derivative approach

Vibrational Spectroscopy

Volumn 10, Issue 2, 1996, Pages 125-138

  Toft, J ^a,c   Cuesta Sanchez F ^a   Van Den Bogaert, B ^a   Libnau, F O ^b   Massart, D L ^a  

^a VRIJE UNIVERSITEIT BRUSSEL   (Belgium)

^b UNIVERSITY OF BERGEN   (Norway)

^c NONE   (Norway)

Author keywords

Infrared spectrometry; Mid infrared spectrometry; Overlapping spectra; Second order derivative; SIMPLISMA

Indexed keywords

EID: 0013441506     PISSN: 09242031     EISSN: None     Source Type: Journal    
DOI: 10.1016/0924-2031(95)00035-6     Document Type: Article

References (25)

1. P. Gans, Data Fitting in the Chemical Science by the Methods of Least Squares, Wiley, Chichester, 1992, pp. 181-189.
2. W.H. Lawton and E.A. Sylvestre, Technometrics, 13 (1971) 617-633.
3. W. Windig and J. Guilment, Anal. Chem., 63 (1991) 1425-1432.
4. P.J. Gemperline, J. Chem. Inf. Comput. Sci., 24 (1984) 206-212.
5. B.G.M. Vandeginste, W. Derks and G. Kateman, Anal. Chim. Acta, 173 (1987) 57-71.
6. E. Karjalainen, Chemom. Intel. Lab. Syst., 7 (1989) 31-38.
7. M. Maeder and A.Z. Zuberbuehler, Anal. Chim. Acta, 181 (1986) 287-281.
8. O.M. Kvalheim and Y.-z. Liang, Anal. Chem. 64 (1992) 936-946.
9. F.O. Libnau, J. Toft, A.A. Christy and O.M. Kvalheim, J. Am. Chem. Soc., 116 (1994) 8311-8316.
10. H. Gammp, M. Maeder, C.J. Meyer and D. Zuberbühler, Talanta, 32 (1985) 1133-1139.
11. W. Windig, C.E. Hecler, F.A. Agblevor and R.J. Evans, Chemom. Intel. Lab. Syst., 14 (1992) 195-207.
12. W. Windig and D.A. Stephenson, Anal. Chem., 64 (1992) 2735-2742.
13. W. Windig, Chemom. Intel. Lab. Syst., 23 (1994) 71-86.
14. S.P. Gurden, R.G. Brereton and J.A. Groves, Chemom. Intel. Lab. Syst., 23 (1994) 123-135.
15. M.D. Hämäläinen, Y.-z. Liang, O.M. Kvalheim and R. Andersson, Anal. Chim. Acta, 271 (1993) 101-114.
16. F. Cuesta Sánchez and D.L. Massart, Anal. Chim. Acta, 298 (1994) 331-339.
17. E.R. Malinowski, Anal. Chim. Acta, 134 (1982) 129-137.
18. F. Cuesta Sánchez, M.S. Khots, D.L. Massart and J.O. De Beer, Anal. Chim. Acta, 285 (1994) 181-192.
19. F. Cuesta Sánchez, M.S. Khots and D.L. Massart, Anal. Chim. Acta, 290 (1994) 249-258.
20. F. Cuesta Sánchez et al., Anal. Chem., in press.
21. A. Savitzky and M.J.E. Golay, Anal. Chem., 36 (1964) 1627-1639.
22. D. Eisenberg and W. Kauzmann, The Structure Properties of Water, Oxford University Press, London, 1969.
23. G. Némethy, in W.A.P. Luck (Ed.), Structure of Water and Aqueous Solutions, Verlag Chemie, Weinheim/Bergstrasse, 1974, p. 73.
24. S.W. Benson and E.D. Siebert, J. Am. Chem. Soc., 114 (1992) 4269-4276.
25. D.E. Hare and C.M. Sorenson, J. Chem. Phys., 93 (1990) 25-33.