G. Brocks

Wang, Y. ., Sorkun, M. ., Brocks, G. ., & Er, S. . (2024). ML-Aided Computational Screening of 2D Materials for Photocatalytic Water Splitting. Journal of Physical Chemistry Letters, 15(18), 4983-4991. https://doi.org/10.1021/acs.jpclett.4c00425 (Original work published 2024)

Wang, Y. ., Brocks, G. ., & Er, S. . (2024). Data-Driven Discovery of Intrinsic Direct-Gap 2D Materials as Potential Photocatalysts for Efficient Water Splitting. ACS Catalysis, 14(3), 1336-1350. https://doi.org/10.1021/acscatal.3c05181 (Original work published 2024)

Liang, Q. ., Brocks, G. ., & Bieberle-Hütter, A. . (2023). First-principles study of the magnetic exchange forces between the RuO2(110) surface and Fe tip. ChemPhysChem, 24(5), e202200429. https://doi.org/10.1002/cphc.202200429 (Original work published 2023)

Onwudinanti, C. ., Pols, M. ., Brocks, G. ., Koelman, J. M. V. A., van Duin, A. T., Morgan, T. W., & Tao, S. . (2022). A ReaxFF molecular dynamics study of hydrogen diffusion in ruthenium - the role of grain boundaries. Journal of Physical Chemistry C, 126(13), 5950-5959. https://doi.org/10.1021/acs.jpcc.1c08776 (Original work published 2022)

Liang, Y. ., Bieberle-Hütter, A. ., & Brocks, G. . (2022). Anti-Ferromagnetic RuO2: A Stable and Robust OER Catalyst over a Large Range of Surface Terminations. Journal of Physical Chemistry C, 126(3), 1337–1345. https://doi.org/10.1021/acs.jpcc.1c08700 (Original work published 2022)

Liang, Q. ., Brocks, G. ., & Bieberle-Hütter, A. . (2021). Oxygen evolution reaction (OER) mechanism under alkaline and acidic conditions. JPhys Energy, 3(2), 026001. https://doi.org/10.1088/2515-7655/abdc85 (Original work published 2021)

Onwudinanti, C. ., Brocks, G. ., Koelman, J. M. V. A., Morgan, T. W., & Tao, S. . (2021). Tin deposition on ruthenium and its influence on blistering in multi-layer mirrors. Physical Chemistry Chemical Physics, 23(25), 13878-13884. https://doi.org/10.1039/d1cp01082d (Original work published 2021)

Liang, Q. ., Brocks, G. ., Sinha, V. ., & Bieberle-Hütter, A. . (2021). Tailoring the performance of ZnO for oxygen evolution by effective transition metal doping. ChemSusChem, 14(15), 3064-3073. https://doi.org/10.1002/cssc.202100715 (Original work published 2021)

Onwudinanti, C. ., Brocks, G. ., Koelman, J. M. V. A., Morgan, T. W., & Tao, S. X. (2020). Hydrogen diffusion out of ruthenium - an ab initio study of the role of adsorbates. Physical Chemistry Chemical Physics, 22(15), 7935-7941. https://doi.org/10.1039/d0cp00448k (Original work published 2020)

Li, N. X., Tao, S. X., Chen, Y. ., Niu, X. X., Onwudinanti, C. K., Hu, C. ., … Zhou, H. P. (2019). Cation and anion immobilization through chemical bonding enhancement with fluorides for stable halide perovskite solar cells. Nature Energy, 4(5), 408-415. https://doi.org/10.1038/s41560-019-0382-6 (Original work published 2019)