Articles | Volume 9, issue 2
Geosci. Model Dev., 9, 899–914, 2016
https://doi.org/10.5194/gmd-9-899-2016
Geosci. Model Dev., 9, 899–914, 2016
https://doi.org/10.5194/gmd-9-899-2016

Model description paper 01 Mar 2016

Model description paper | 01 Mar 2016

UManSysProp v1.0: an online and open-source facility for molecular property prediction and atmospheric aerosol calculations

David Topping et al.

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In this paper we describe the development and application of a new web-based and open-source facility, UManSysProp (http://umansysprop .seaes.manchester.ac.uk), for automating predictions of molecular and atmospheric aerosol properties. Current facilities include pure component vapour pressures, critical properties, and sub-cooled densities of organic molecules; activity coefficient predictions for mixed inorganic-organic liquid systems; hygroscopic growth factors and CCN activation potential.