SPARC (Sparc Performs Automated Reasoning in Chemistry)Using the molecular structure model gas/particle partitioningcoefficient (Kp) is calculated using the formula: Kp f wiom K wiom K wiom - sorption coefficient calculated with SPARC softvare (ciWIOM/ciair) f wiom - mass fraction of water insoluble organic matter (wiom) in aerosol (recomended value 40%)
SPARC (Sparc Performs Automated Reasoning in Chemistry)The model was validated for three types of WIOM polymers Secondary organic aerosol polymers used in calculations as organic matter surrogate
Locations in Novi SadN1-NIS refinery,N2-Sangaj kindergarden,N3-Citys Assembly
ConclusionPredictions for PAHs with carcinogenic, mutagenic andteratogenic properties are close to linear relationship, whichmeans that SPARC model can be used for prediction ofpartitioning and distribution processes.
The study of partition processesheterogenic system • air/water • air/soil • water/soilare in progress.
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