Jc. Seitz et al., QUANTITATIVE-ANALYSIS OF MIXED VOLATILE FLUIDS BY RAMAN MICROPROBE SPECTROSCOPY - A CAUTIONARY NOTE ON SPECTRAL RESOLUTION AND PEAK SHAPE, Applied spectroscopy, 47(6), 1993, pp. 816-820
Raman analyses of fluid inclusions can yield quantitative information
on composition (from peak areas and heights) and density (from peak po
sition and width). In this study, we examine the effect of instrumenta
l spectral resolution on the ratios of these spectral parameters, and
the selection of appropriate integration limits for the determination
of peak areas in the CO2-CH4-N2 system. Spectral resolution was varied
from about 1 to 9 cm-1 by co-varying the widths of all spectrometer s
lits. Changes in resolution produced a modest effect on peak-area rati
os and a significant effect on peak-height ratios. Measured peak-width
ratios varied strongly as a function of the spectral resolution. In a
ddition, we observed a moderate shift in the measured peak position of
N2, which can be related to the asymmetry of the band. These results
indicate that accurate analysis requires careful attention to the sele
ction of quantification factors, especially if the selected values wer
e derived from studies at different spectral resolutions. Another fact
or that can have a significant effect on the calculated compositions o
f CH4- and H-2-bearing fluid mixtures is the band broadening that occu
rs with increasing pressure.