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Experimental validation of calculated atomic charges in ionic liquids.
Fogarty RM, Matthews RP, Ashworth CR, Brandt-Talbot A, Palgrave RG, Bourne RA, Vander Hoogerstraete T, Hunt PA, Lovelock KRJ. Fogarty RM, et al. Among authors: ashworth cr. J Chem Phys. 2018 May 21;148(19):193817. doi: 10.1063/1.5011662. J Chem Phys. 2018. PMID: 30307226 Free article.
Hydrogen bonding in ionic liquids.
Hunt PA, Ashworth CR, Matthews RP. Hunt PA, et al. Among authors: ashworth cr. Chem Soc Rev. 2015 Mar 7;44(5):1257-88. doi: 10.1039/c4cs00278d. Chem Soc Rev. 2015. PMID: 25582457
Atomic charges of sulfur in ionic liquids: experiments and calculations.
Fogarty RM, Rowe R, Matthews RP, Clough MT, Ashworth CR, Brandt A, Corbett PJ, Palgrave RG, Smith EF, Bourne RA, Chamberlain TW, Thompson PBJ, Hunt PA, Lovelock KRJ. Fogarty RM, et al. Among authors: ashworth cr. Faraday Discuss. 2017 Dec 14;206:183-201. doi: 10.1039/c7fd00155j. Faraday Discuss. 2017. PMID: 29068464 Free article.
NEXAFS spectroscopy of ionic liquids: experiments versus calculations.
Fogarty RM, Matthews RP, Clough MT, Ashworth CR, Brandt-Talbot A, Corbett PJ, Palgrave RG, Bourne RA, Chamberlain TW, Vander Hoogerstraete T, Thompson PBJ, Hunt PA, Besley NA, Lovelock KRJ. Fogarty RM, et al. Among authors: ashworth cr. Phys Chem Chem Phys. 2017 Nov 29;19(46):31156-31167. doi: 10.1039/c7cp07143d. Phys Chem Chem Phys. 2017. PMID: 29139509 Free article.
A step towards the a priori design of ionic liquids.
Niedermeyer H, Ashworth C, Brandt A, Welton T, Hunt PA. Niedermeyer H, et al. Phys Chem Chem Phys. 2013 Jul 21;15(27):11566-78. doi: 10.1039/c3cp50521a. Epub 2013 Jun 10. Phys Chem Chem Phys. 2013. PMID: 23752557 Free article.
30 results