Publications of the junior research group

M. Arnold, J. Katzmann, A. Naik, A. L. Görne, T. Härtling, J. George, C. Schuster and J. Mater, "Investigations on electron beam irradiated rare-earth doped SrF₂ for application as low fading dosimeter material: evidence for and DFT simulation of a radiation-induced phase", Chem. C 32 (2022).  DOI 10.1039/D2TC01773CExternal link

J. George, G. Petretto, A. Naik, M. Esters, A. J. Jackson, R. Nelson, R. Dronskowski, G.-M. Rignanese and G. Hautier, "Automated Bonding Analysis with Crystal Orbital Hamilton Populations", ChemPlusChem Vol. 87 (2022). DOI 10.1002/cplu.202200123External link

T. Bernges, R. Hanus, B. Wankmiller, K. Imasato, S. Lin, M. Ghidiu, M. Gerlitz, M. Peterlechner, S. Graham, G. Hautier, Y. Pei, M. R. Hansen, G. Wilde, G. J. Snyder, J. George, M. T. Agne and W. G. Zeier, "Considering the Role of Ion Transport in Diffuson-Dominated Thermal Conductivity", Advanced Energy Materials 12, 2200717 (2022).  DOI 10.1002/aenm.202200717External link

J. George, "Automation in DFT-based computational materials science", Trends Chem. 3, 697–699 (2021). DOI 10.1016/j.trechm.2021.07.001External link