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• W2275582393 abstract "Summary Due to its generality, the solvation model COSMO‐RS can be used for a priori predictions of thermodynamic data for short‐lived reactive species. In this paper, a strategy is outlined how COSMO‐RS results can be employed as input in process simulations of reactive multiphase systems. As an example, the applicability of the method is demonstrated on prediction of partition coefficients for AIBN and corresponding azo‐radicals between aqueous and organic phases." @default.
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• W2275582393 date "2016-02-01" @default.
• W2275582393 modified "2023-10-16" @default.
• W2275582393 title "Partition Coefficient of AIBN and Associated Radicals Between Aqueous and Organic Phase: Benchmark of Predictions with the COSMO-RS Model and Perspective for the Use in Kinetic Modelling of Multiphase Systems" @default.
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• W2275582393 doi "https://doi.org/10.1002/masy.201500118" @default.
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