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5063 Publications
2022 | Journal Article | LibreCat-ID: 37710
Ruiz Alvarado, I. A., & Schmidt, W. G. (2022). Water/InP(001) from Density Functional Theory. ACS Omega, 7(23), 19355–19364. https://doi.org/10.1021/acsomega.2c00948
LibreCat
| DOI
2022 | Journal Article | LibreCat-ID: 37681
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 & Interfaces, 14(41), 47255–47261. https://doi.org/10.1021/acsami.2c13352
LibreCat
| DOI
2022 | Journal Article | LibreCat-ID: 37714
Karmo, M., Ruiz Alvarado, I. A., Schmidt, W. G., & Runge, E. (2022). Reconstructions of the As-Terminated GaAs(001) Surface Exposed to Atomic Hydrogen. ACS Omega, 7(6), 5064–5068. https://doi.org/10.1021/acsomega.1c06019
LibreCat
| DOI
2022 | Book Chapter | LibreCat-ID: 29808
Schindlmayr, A. (2022). Programmierung und Computersimulationen. In J. Gerick, A. Sommer, & G. Zimmermann (Eds.), Kompetent Prüfungen gestalten: 60 Prüfungsformate für die Hochschullehre (2nd ed., pp. 270–274). Waxmann. https://doi.org/10.36198/9783838558592
LibreCat
| DOI
2022 | Journal Article | LibreCat-ID: 34884
Prasannan, N., Sperling, J., Brecht, B., & Silberhorn, C. (2022). Direct Measurement of Higher-Order Nonlinear Polarization Squeezing. Physical Review Letters, 129(26), Article 263601. https://doi.org/10.1103/physrevlett.129.263601
LibreCat
| DOI
2022 | Journal Article | LibreCat-ID: 40423
Bauch, F., Dong, C.-D., & Schumacher, S. (2022). Protonation-induced charge transfer and polaron formation in organic semiconductors doped by Lewis acids. RSC Advances, 12(22), 13999–14006. https://doi.org/10.1039/d2ra02032g
LibreCat
| DOI
2022 | Journal Article | LibreCat-ID: 40425
Bathe, T., Dong, C.-D., & Schumacher, S. (2022). Microscopic Study of Molecular Double Doping. The Journal of Physical Chemistry A, 126(13), 2075–2081. https://doi.org/10.1021/acs.jpca.1c09179
LibreCat
| DOI
2022 | Journal Article | LibreCat-ID: 33965 | 
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
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2022 | Journal Article | LibreCat-ID: 31254
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
LibreCat
| DOI
2022 | Journal Article | LibreCat-ID: 40154
Krüger, J. T., Hoyer, K.-P., Huang, J., Filor, V., Mateus-Vargas, R. H., Oltmanns, H., Meißner, J., Grundmeier, G., & Schaper, M. (2022). FeMn with Phases of a Degradable Ag Alloy for Residue-Free and Adapted Bioresorbability. Journal of Functional Biomaterials, 13(4), 185. https://doi.org/10.3390/jfb13040185
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2022 | Journal Article | LibreCat-ID: 34652
Vieth, P., Garthe, M.-A., Voswinkel, D., Schaper, M., & Grundmeier, G. (2022). Enhancement of the delamination resistance of adhesive film coated surface laser melted aluminum 7075-T6 alloy by aminophosphonic acid adsorption. Surface and Coatings Technology, 447, Article 128835. https://doi.org/10.1016/j.surfcoat.2022.128835
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2022 | Journal Article | LibreCat-ID: 30103
Huang, J., Orive, A. G., Krüger, J. T., Hoyer, K.-P., Keller, A., & Grundmeier, G. (2022). Influence of proteins on the corrosion of a conventional and selective laser beam melted FeMn alloy in physiological electrolytes. Corrosion Science, 200, 110186. https://doi.org/10.1016/j.corsci.2022.110186
LibreCat
| DOI
2022 | Journal Article | LibreCat-ID: 34654
Kusoglu, I. M., Vieth, P., Heiland, S., Huber, F., Lüddecke, A., Ziefuss, A. R., Kwade, A., Schmidt, M., Schaper, M., Barcikowski, S., & Grundmeier, G. (2022). Microstructure and corrosion properties of PBF-LB produced carbide nanoparticles additivated AlSi10Mg parts. Procedia CIRP, 111, 10–13. https://doi.org/10.1016/j.procir.2022.08.046
LibreCat
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2022 | Conference Abstract | LibreCat-ID: 44376
Tonbul, G., Kappler, J., Murugan, S., Schoch, R., Nowakowski, M., Lange, P., Bauer, M., & Buchmeiser, M. R. (2022). Development of Battery System Based on Na-S and Characterization Using X-ray Absorption Spectroscopy. Electrochem2022 & 63rd Corrosion Science Symposium, Edinburgh.
LibreCat
2022 | Journal Article | LibreCat-ID: 32068
Ahmed, H., Intaravanne, Y., Ming, Y., Ansari, M. A., Buller, G. S., Zentgraf, T., & Chen, X. (2022). Multichannel Superposition of Grafted Perfect Vortex Beams. Advanced Materials, 34(30), Article 2203044. https://doi.org/10.1002/adma.202203044
LibreCat
| DOI
2022 | Journal Article | LibreCat-ID: 45007
Yang, Y., Cheramy, J., Brehm, M., & Xu, Y. (2022). Raman Optical Activity of N-Acetyl-L-Cysteine in Water and in Methanol: The “Clusters-in-a-Liquid” Model and ab initio Molecular Dynamics Simulations. ChemPhysChem, 23 (11), e202200161. https://doi.org/10.1002/cphc.202200161
LibreCat
| DOI
2022 | Journal Article | LibreCat-ID: 45010
Chahal, R., Roy, S., Brehm, M., Banerjee, S., Bryantsev, V., & Lam, S. (2022). Transferable Deep Learning Potential Reveals Intermediate-Range Ordering Effects in LiF–NaF–ZrF4 Molten Salt. JACS Au, 2 (12), 2693–2702. https://doi.org/10.1021/jacsau.2c00526
LibreCat
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2022 | Journal Article | LibreCat-ID: 45008
Taherivardanjani, S., Blasius, J., Brehm, M., Dötzer, R., & Kirchner, B. (2022). Conformer Weighting and Differently Sized Cluster Weighting for Nicotine and its Phosphorus Derivatives. J. Phys. Chem. A, 126 (40), 7070–7083. https://doi.org/10.1021/acs.jpca.2c03133
LibreCat
| DOI
2022 | Journal Article | LibreCat-ID: 45009
Frömbgen, T., Blasius, J., Alizadeh, V., Chaumont, A., Brehm, M., & Kirchner, B. (2022). Cluster Analysis in Liquids: A Novel Tool in TRAVIS. J. Chem. Inf. Model., 62 (22), 5634–5644. https://doi.org/10.1021/acs.jcim.2c01244
LibreCat
| DOI
2022 | Journal Article | LibreCat-ID: 45121
Gokeler, A., Grassi, A., Hoogeslag, R., van Houten, A., Lehmann, T., Bolling, C., Buckthorpe, M., Norte, G., Benjaminse, A., Heuvelmans, P., Di Paolo, S., Tak, I., & Villa, F. D. (2022). Return to sports after ACL injury 5 years from now: 10 things we must do. Journal of Experimental Orthopaedics, 9(1), Article 73. https://doi.org/10.1186/s40634-022-00514-7
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