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Matches in SemOpenAlex for { <https://semopenalex.org/work/W2007996361> ?p ?o ?g. }

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• W2007996361 abstract "Matrices of severely overlapping mid-infrared mixture spectra have been resolved into the pure compounds' spectra and concentration profiles using SIMPLISMA and a 2nd order derivative approach. For a three-compound mixture system of organic solvents, SIMPLISMA qualitatively resolves the spectra satisfactorily while it provides only semi-quantitative concentrations. Quantitative results are obtained by applying an additional iterative procedure. Applied to water spectra acquired in the temperature range 2–96°C, SIMPLISMA resolves two spectra. Using a discrete model, these spectra can be interpreted as corresponding to water structures constructed of H2O molecules with a relatively high and low average number of H-bonds. After an optimising procedure the estimated enthalpy was 2.3 kcal mol−1, which is in accordance with figures found in literature." @default.
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• W2007996361 date "1996-01-01" @default.
• W2007996361 modified "2023-10-14" @default.
• W2007996361 title "Resolution of overlapping mid-infrared spectra using SIMPLISMA and a second-order derivative approach" @default.
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• W2007996361 doi "https://doi.org/10.1016/0924-2031(95)00035-6" @default.
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