Dr Magdalena Pascual Borràs

2017 Postdoc Umeå University, SE
2017 PhD Universitat Rovira i Virgili, ES
2012 MSc Universitat Rovira i Virgili, ES
2011 BSc Universitat Rovira i Virgili, ES

Dr Magdalena Pascual Borràs holds a PhD in computational chemistry from the Universitat Rovira i Virgili in Tarragona in Catalonia, where she looked at the computational modelling of polyoxometalates. She is currently doing a postdoc with Andy Ohlin, where her focus is on the computational and experimental resolution of the reactivity of discrete metal oxides.


5. “Protonation and water exchange kinetics in sandwich polyoxometalates”
C.A. Ohlin, M. Pascual-Borràs
Dalton Trans. 2018, 47, 13602-13607.

4. “Bonding Insights from Structural and Spectroscopic Comparisons of {SnW5} and {TiW5} Alkoxido- and Aryloxido-Substituted Lindqvist Polyoxometalates”
B. Kandasamy, P.G. Bruce, W. Clegg, R.W. Harrington, A. Rodríguez-Fortea, M. Pascual-Borràs, R. J. Errington
Chem. – Eur. J. 2018, 24(11), 2750-2757.

3. “Synthesis, structure and antibacterial activity of thallium (III)-containing polyoxometalate”
W. W. Ayass, T. Fodor, Z. Lin, R. M. Smith, X. Xing, K. Abdallah, I. Tóth, L. Zékány, M.
Pascual-Borràs, A. Rodríguez-Fortea, J. M. Poblet, L. Fan, J. Cao, B. Keita, M. S. Ullrich, U. Kortz
Inorg. Chem. 2016, 55, 10118

2. “Accurate calculations of 31P NMR chemical shifts in polyoxometalates”
M. Pascual-Borràs, X. López and J.M. Poblet
Phys. Chem. Chem. Phys. 2015, 17, 8723

1. “17O NMR Chemical Shifts in Oxometalates: From the Simplest Monometallic Species to Mixed-metal Polyoxometalates”
M. Pascual-Borràs, X. López, A. Rodríguez-Fortea, R. J. Errington and J.M. Poblet
Chem. Sci. 2014, 5, 2031