evaluation of vapor pressure estimation methods for use in simulating the dynamic of atmospheric organic aerosols
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2013
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Abstract
The modified Mackay (mM), the Grain-Watson (GW), Myrdal and Yalkovsky (MY),
Lee and Kesler (LK), and Ambrose-Walton (AW) methods for estimating vapor pressures () are tested against experimental data for a set of volatile organic compounds (VOC). required to determine gas-particle partitioning of such organic compounds is used as a parameter for simulating the dynamic of atmospheric aerosols. Here, we use the structure-property relationships of VOC to estimate . The accuracy of each of the aforementioned methods is also assessed for each class of compounds (hydrocarbons, monofunctionalized, difunctionalized, and tri- and more functionalized volatile organic species). It is found that the best method for each VOC depends on its functionality.
| Reference Key |
mbienda2013internationalevaluation
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|---|---|
| Authors | ;A. J. Komkoua Mbienda;C. Tchawoua;D. A. Vondou;F. Mkankam Kamga |
| Journal | organometallics |
| Year | 2013 |
| DOI |
10.1155/2013/612375
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| URL | |
| Keywords |
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