Metastable Polymorphs - Developing Surface-Induced Processing Conditions for Organic Nanotechnology

Peer-reviewed publications

	J. J. Cartus, A. Jeindl, A. Werkovits, L. Hörmann, O. T. Hofmann, Polymorphism meidated by electric fields: a first principles study on organic/inorganic interfaces Nanoscale Advances 2023, 8, 5, 2288-2298 https://doi.org/10.1039/D2NA00851C
	B. Ramsauer, G. J. Simpson, J. J. Cartus, A. Jeindl, V, Garcia-Lopez, J. M. Tour, L. Grill, O. T. Hofmann, Autonomous Single-Molecule Manipulation Based on Reinforcement Learning, J. Phys. Chem. A, 2023, 127, 8, 2041-2050 https://pubs.acs.org/doi/10.1021/acs.jpca.2c08696
	R. K. Berger, A. Jeindl, L. Hörmann, O.T. Hofmann, Role of Adatoms for the Adsorption of F4TCNQ on Au(111), J. Phys. Chem. C., 2002, 126, 17, 7718-7727 https://pubs.acs.org/doi/10.1021/acs.jpcc.2c00994
	L. Hörmann, A. Jeindl, O.T. Hofmann, Note: Reproducibility of potential energy surfaces of organic/metal interfaces on the example of PTCDA on Ag(111), J. Chem. Phys, 2022, 156, 206101 https://doi.org/10.1063/5.0094163
	M. Wagner, F. Calcinelli, A. Jeindl, M. Schmid, O. T. Hofmann, U. Diebold, Adsorption configurations of Co-phthalocyanine on In2O3, Surface Science 2022, 722, 122065 https://doi.org/10.1016/j.susc.2022.122065
	L. Hörmann, A. Jeindl, O. T. Hofmann, From a bistable adsorbate to a switchable interface: tetrachloropyrazine on Pt(111), Nanoscale, 2002, 14 5154 https://doi.org/10.1039/D1NR07763E
	J. J. Cartus, A. Jeindl, O. T. Hofmann, Can We Predict Interface Properties Based on Molecular Properties? Appl. Surf. Sci 2022, 575, 151687 https://doi.org/10.1016/j.apsusc.2021.151687
	A. Jeindl, L. Hörmann, O. T. Hofmann, How much does surface polymorphism influence the work function of organic/metal interfaces? Appl. Surf. Sci 2022, 575, 151687 https://doi.org/10.1016/j.apsusc.2021.151687
	A. Werkovits, A. Jeindl, L. Hörmann, J. J. Cartus, O. T. Hofmann, Toward Targeted Kinetic Trapping of Organic-Inorganic Interfaces: A Computational Case Study ACS Phys. Chem. Au 2022, 2, 1, 38-46 https://pubs.acs.org/doi/10.1021/acsphyschemau.1c00015
	A. Stein, D. Rolf, C. Lotze, S. Feldmann, D. Gerbert, B. Günther, A. Jeindl, J. J. Cartus, O. T. Hofmann, L. H: Gade, K. J. Franke, P. Tegeder, Electronic Properties of Tetraazaperopyrene Derivatives on Au(111): Energy-Level Alignment and Interfacial Band Formation J. Phys. Chem. C., 2021, 125, 36, 19969-19979 https://pubs.acs.org/doi/10.1021/acs.jpcc.1c04217
	A. Jeindl, J. Domke, L. Hörmann, F. Sojka, R. Forker, T. Fritz, O. T. Hofmann, Nonintuitive Surface Self-Assembly of Functionalized Molecules on Ag(111) ACS Nano 2021, acsnano.0c10065. https://doi.org/10.1021/acsnano.0c10065
	O. T. Hofmann, E. Zojer, L. Hörmann, A. Jeindl, R. J. Maurer, First-Principles Calculations of Hybrid Inorganic-Organic Interfaces: From State-of-the-Art to Best Practice. Phys. Chem. Chem. Phys. 2021, 10.1039.D0CP06605B. https://doi.org/10.1039/D0CP06605B
	L. Hörmann, A. Jeindl, O.T. Hofmann, Reproducibility of Potential Energy Surfaces of Organic/Inorganic Interfaces on the Example of PTCDA on Ag(111). The Journal of Chemical Physics, 2021, 153, 10, 104701, https://doi.org/10.1063/5.0020736
	A. T. Egger, L. Hörmann, A. Jeindl, M. Scherbela, M. V. Obersteiner, M. Todorović, P. Rinke, O. T. Hofmann, Charge Transfer into Organic Thin Films: A Deeper Insight through Machine‐Learning‐Assisted Structure Search. Adv. Sci. 2020, 2000992. https://doi.org/10.1002/advs.202000992.
	M. G. H. Schulte, A. Jeindl, I. Baltaci, P. Roese, M. Schmitz, U. Berges, O.T. Hofmann, C. Westphal, Structural Investigation of Caffeine Monolayers on Au(111). Phys. Rev. B 2020, 101 (24), 245414. https://doi.org/10.1103/PhysRevB.101.245414.
	L. Hörmann, A. Jeindl, A. T. Egger, M. Scherbela, O. T. Hofmann SAMPLE: Surface Structure Search Enabled by Coarse Graining and Statistical Learning. Computer Physics Communications 2019, 244, 143–155. https://doi.org/10.1016/j.cpc.2019.06.010