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Moritz, D. C., Ruiz Alvarado, I. A., Zare Pour, M. A., Paszuk, A., Frieß, T., Runge, E., Hofmann, J. P., Hannappel, T., Schmidt, W. G., &; Jaegermann, W. (2022). P-Terminated InP(001) Surfaces: Surface Band Bending and Reactivity to Water. ACS Applied Materials &;amp; Interfaces, 14(41), 47255–47261.https://doi.org/10.1021/acsami.2c13352 

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Murzakhanov, F. F., Mamin, G. V., Orlinskii, S. B., Gerstmann, U., Schmidt, W. G., Biktagirov, T., Aharonovich, I., Gottscholl, A., Sperlich, A., Dyakonov, V., &; Soltamov, V. A. (2022). Electron–Nuclear Coherent Coupling and Nuclear Spin Readout through Optically Polarized V<sub>B</sub><sup>–</sup> Spin States in hBN. Nano Letters, 22(7), 2718–2724.https://doi.org/10.1021/acs.nanolett.1c04610 

Bocchini, A., Gerstmann, U., Bartley, T., Steinrück, H.-G., Henkel, G., &; Schmidt, W. G. (2022). Electrochemical performance of KTiOAsO_4 (KTA) in potassium-ion batteries from density-functional theory. Phys. Rev. Materials, 6, 105401.https://doi.org/10.1103/PhysRevMaterials.6.105401 

Bocchini, A., Gerstmann, U., &; Schmidt, W. G. (2022). Oxygen vacancies in KTiOPO_4: Optical absorption from hybrid DFT. Phys. Rev. B, 105, 205118.https://doi.org/10.1103/PhysRevB.105.205118 

Schulz, A. M., Wecker, C., Inguva, V., Lopatin, A. S., &; Kenig, E. Y. (2022). A PLIC-based method for species mass transfer at free fluid interfaces. Chemical Engineering Science, 250.https://doi.org/10.1016/j.ces.2021.117357 

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