https://nova.newcastle.edu.au/vital/access/ /manager/Index ${session.getAttribute("locale")} 5 Formation of persistent organic pollutants from 2,4,5-trichlorothiophenol combustion: a density functional theory investigation https://nova.newcastle.edu.au/vital/access/ /manager/Repository/uon:26103 Wed 24 Jul 2019 13:16:20 AEST ]]> Thermal studies of chlorinated thiophenols https://nova.newcastle.edu.au/vital/access/ /manager/Repository/uon:24483 Wed 11 Apr 2018 11:01:53 AEST ]]> Quantum chemical study on formation of PCDT/TA from 2-chlorothiophenol precursor https://nova.newcastle.edu.au/vital/access/ /manager/Repository/uon:20094 Sat 24 Mar 2018 08:00:07 AEDT ]]> Thermochemical parameters and pK<sub>a</sub> values for chlorinated congeners of thiophenol https://nova.newcastle.edu.au/vital/access/ /manager/Repository/uon:22299 a values based on gas phase deprotonation free energies and calculated solvation energies for chlorinated thiophenol molecules and chlorinated thiophenolate anions. Calculated pKa values are in good agreement with limited available experimental measurements.]]> Sat 24 Mar 2018 07:11:06 AEDT ]]>