Most protocols used for open-path Fourier transform infrared spectrometry (
OP/FT-IR) require that spectra be measured at a resolution of 1 cm(-1) and
that the concentrations of the analytes be calculated by classical least sq
uares regression (CLS). These specifications were largely developed for mon
itoring light molecules with easily resolvable rotational fine structure. F
or most volatile organic compounds in air, the rotational fine structure is
not resolvable and better accuracy can be obtained when the spectrum is me
asured at lower resolution (typically 8 cm-l), provided that the algorithm
used for quantification is partial least squares regression (PLS). By measu
ring the spectrum at low resolution, the need for a liquid-nitrogen-cooled
mercury cadmium telluride detector is reduced and a pyroelectric detector o
perating at ambient temperature can be used instead. By using PLS rather th
an CLS, spectral features due to water vapor do not have to be compensated
and a short-path background spectrum can be used, greatly simplifying field
measurements. (C) 2000 Elsevier Science B.V. All rights reserved.