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Wagner, C.; Ferrari, A.; Schreuer, J.; Couzinie, J.-P.; Ikeda, Y.; Körmann, F.; Eggeler, G. F.; George, E. P.; Laplanche, G.: Effects of Cr/Ni ratio on physical properties of Cr–Mn–Fe–Co–Ni high-entropy alloys. Acta Materialia 227, 117693 (2022)

Chakraborty, J.; Oellers, T.; Raghavan, R.; Ludwig, A.; Dehm, G.: Microstructure and residual stress evolution in nanocrystalline Cu–Zr thin films. Journal of Alloys and Compounds 896, 162799 (2022)

Liu, C.; Davis , A.; Fellowes, J.; Prangnell, P.; Raabe, D.; Shanthraj, P.: CALPHAD-informed phase-field model for two-sublattice phases based on chemical potentials: η-phase precipitation in Al–Zn–Mg–Cu alloys. Acta Materialia 226, 117602 (2022)

Poplawsky, J. D.; Pillai, R.; Ren, Q.-Q.; Breen, A. J.; Gault, B.; Brady, M. P.: Measuring oxygen solubility in Ni grains and boundaries after oxidation using atom probe tomography. Scripta Materialia 210, 114411 (2022)

Zhou, X.; Wei, Y.; Kühbach, M. T.; Zhao, H.; Vogel, F.; Kamachali, R. D.; Thompson, G. B.; Raabe, D.; Gault, B.: Revealing in-plane grain boundary composition features through machine learning from atom probe tomography data. Acta Materialia 226, 117633 (2022)

Khanchandani, H.; Kim, S.-H.; Varanasi, R. S.; Prithiv, T. S.; Stephenson, L.; Gault, B.: Hydrogen and deuterium charging of lifted-out specimens for atom probe tomography [version 2; peer review: 1 approved, 1 approved with reservations]. Open Research Europe 1 (122) (2022)

Mendive-Tapia, E.; Neugebauer, J.; Hickel, T.: Ab initio calculation of the magnetic Gibbs free energy of materials using magnetically constrained supercells. Physical Review B 105 (16), 064425 (2022)

Zhao, H.; Chakraborty, P.; Ponge, D.; Hickel, T.; Sun, B.; Wu, C.-H.; Gault, B.; Raabe, D.: Hydrogen trapping and embrittlement in high-strength Al-alloys. Nature 602, pp. 437 - 441 (2022)

Khanchandani, H.; El-Zoka, A.; Kim, S.-H.; Tezins, U.; Vogel, D.; Sturm, A.; Raabe, D.; Gault, B.; Stephenson, L.: Laser-equipped gas reaction chamber for probing environmentally sensitive materials at near atomic scale. PLoS One 17 (2), e0262543 (2022)

Yoo, S.-H.; Kim, S.-H.; Woods, E.; Gault, B.; Todorova, M.; Neugebauer, J.: Origins of the hydrogen signal in atom probe tomography: case studies of alkali and noble metals. New Journal of Physics 24, 013008 (2022)

Sreekala, L.; Dey, P.; Hickel, T.; Neugebauer, J.: Unveiling nonmonotonic chemical trends in the solubility of H in complex Fe–Cr–Mn carbides by means of ab initio based approaches. Physical Review Materials 6 (1), 014403 (2022)

Freysoldt, C.; Neugebauer, J.; Tan, A. M. Z.; Hennig, R. G.: Limitations of empirical supercell extrapolation for calculations of point defects in bulk, at surfaces, and in two-dimensional materials. Physical Review B 105 (1), 014103 (2022)

Kim, S.-H.; Yoo, S.-H.; Chakraborty, P.; Jeong, J.; Lim, J.; El-Zoka, A.; Zhou, X.; Stephenson, L.; Hickel, T.; Neugebauer, J. et al.; Scheu, C.; Todorova, M.; Gault, B.: Understanding Alkali Contamination in Colloidal Nanomaterials to Unlock Grain Boundary Impurity Engineering. Journal of the American Chemical Society 144 (2), pp. 987 - 994 (2022)

Aymerich Armengol, R.; Cignoni, P.; Ebbinghaus, P.; Linnemann, J.; Rabe, M.; Tschulik, K.; Scheu, C.; Lim, J.: Mechanism of coupled phase/morphology transformation of 2D manganese oxides through Fe galvanic exchange reaction. Journal of Materials Chemistry A 10 (45), pp. 24190 - 24198 (2022)

Baumgartner, L.-M.; Erbe, A.; Boyle, A. L.; Rabe, M.: Controlling Amphipathic Peptide Adsorption by Smart Switchable Germanium Interfaces. Physical Chemistry Chemical Physics, p. - (2022)

Bhatt, S.; Katnagallu, S.; Neugebauer, J.; Freysoldt, C.: Accurate computation of chemical contrast in field ion microscopy. Condensed Matter: Materials Science (2022)

Bogdanovski, D.; Poellmann, P. J.; Schneider, J. M.: An ab initio investigation of the temperature-dependent energetic barriers towards CrAlB and (Mo,Cr)AlB formation in a metastable synthesis scenario. Nanoscale 14, pp. 12866 - 12874 (2022)

Distl, B.; Hauschildt, K.; Pyczak, F.; Stein, F.: Phase Equilibria in the Ti-Rich Part of the Ti–Al–Nb System-Part II: High-Temperature Phase Equilibria Between 1000 and 1300 °C. Journal of Phase Equilibra and Diffusion 43, pp. 554 - 575 (2022)

Ferrari, A.; Sotskov, V.; Shapeev, A.; Körmann, F.: Modelling Surface Segregation in Compositionally Complex Alloys with Ab-Initio Accuracy. Condensed Matter: Materials Science (2022)