Publication
2023
- Kabalan, L., Kowalec, I., Rigamonti, S., Troppenz, M., Draxl, C., Catlow, C. R. and Logsdail, A. J. 2023. Investigation of the Pd (1− x ) Zn x alloy phase diagram using ab initio modelling approaches. Journal of Physics: Condensed Matter 35(40), article number: 405402. (10.1088/1361-648x/ace01a)
- Kowalec, I. 2023. Surfaces of Pd-based alloys as catalysts for CO2 activation and hydrogenation to methanol. PhD Thesis, Cardiff University.
2022
- Kowalec, I., Kabalan, L., Catlow, C. R. A. and Logsdail, A. J. 2022. A computational study of direct CO2 hydrogenation to methanol on Pd surfaces. Physical Chemistry Chemical Physics 24(16), pp. 9360-9373. (10.1039/D2CP01019D)
- Crawley, J. W. M. et al. 2022. Heterogeneous trimetallic nanoparticles as catalysts. Chemical Reviews 122(6), pp. 6795-6849. (10.1021/acs.chemrev.1c00493)
2021
- Kabalan, L., Kowalec, I., Catlow, C. R. A. and Logsdail, A. J. 2021. A computational study of the properties of low- and high-index Pd, Cu and Zn surfaces. Physical Chemistry Chemical Physics 23(27), pp. 14649-14661. (10.1039/D1CP01602D)
Articles
- Kabalan, L., Kowalec, I., Rigamonti, S., Troppenz, M., Draxl, C., Catlow, C. R. and Logsdail, A. J. 2023. Investigation of the Pd (1− x ) Zn x alloy phase diagram using ab initio modelling approaches. Journal of Physics: Condensed Matter 35(40), article number: 405402. (10.1088/1361-648x/ace01a)
- Kowalec, I., Kabalan, L., Catlow, C. R. A. and Logsdail, A. J. 2022. A computational study of direct CO2 hydrogenation to methanol on Pd surfaces. Physical Chemistry Chemical Physics 24(16), pp. 9360-9373. (10.1039/D2CP01019D)
- Crawley, J. W. M. et al. 2022. Heterogeneous trimetallic nanoparticles as catalysts. Chemical Reviews 122(6), pp. 6795-6849. (10.1021/acs.chemrev.1c00493)
- Kabalan, L., Kowalec, I., Catlow, C. R. A. and Logsdail, A. J. 2021. A computational study of the properties of low- and high-index Pd, Cu and Zn surfaces. Physical Chemistry Chemical Physics 23(27), pp. 14649-14661. (10.1039/D1CP01602D)
Thesis
- Kowalec, I. 2023. Surfaces of Pd-based alloys as catalysts for CO2 activation and hydrogenation to methanol. PhD Thesis, Cardiff University.