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Spin Manipulation by Creation of Single-Molecule Radical Cations.
Phys Rev Lett. 2016 Jan 15;116(2):027201. doi: 10.1103/PhysRevLett.116.027201. Epub 2016 Jan 15.
Phys Rev Lett. 2016.
PMID: 26824562
Efficient simulation of near-edge x-ray absorption fine structure (NEXAFS) in density-functional theory: Comparison of core-level constraining approaches.
Michelitsch GS, Reuter K.
Michelitsch GS, et al.
J Chem Phys. 2019 Feb 21;150(7):074104. doi: 10.1063/1.5083618.
J Chem Phys. 2019.
PMID: 30795654
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Core Electron Binding Energies in Solids from Periodic All-Electron Δ-Self-Consistent-Field Calculations.
Kahk JM, Michelitsch GS, Maurer RJ, Reuter K, Lischner J.
Kahk JM, et al. Among authors: michelitsch gs.
J Phys Chem Lett. 2021 Sep 30;12(38):9353-9359. doi: 10.1021/acs.jpclett.1c02380. Epub 2021 Sep 22.
J Phys Chem Lett. 2021.
PMID: 34549969
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Communication: Charge-population based dispersion interactions for molecules and materials.
Stöhr M, Michelitsch GS, Tully JC, Reuter K, Maurer RJ.
Stöhr M, et al. Among authors: michelitsch gs.
J Chem Phys. 2016 Apr 21;144(15):151101. doi: 10.1063/1.4947214.
J Chem Phys. 2016.
PMID: 27389199
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Assembly of Robust Holmium-Directed 2D Metal-Organic Coordination Complexes and Networks on the Ag(100) Surface.
Uphoff M, Michelitsch GS, Hellwig R, Reuter K, Brune H, Klappenberger F, Barth JV.
Uphoff M, et al. Among authors: michelitsch gs.
ACS Nano. 2018 Nov 27;12(11):11552-11560. doi: 10.1021/acsnano.8b06704. Epub 2018 Oct 15.
ACS Nano. 2018.
PMID: 30296056
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Remote functionalization in surface-assisted dehalogenation by conformational mechanics: organometallic self-assembly of 3,3',5,5'-tetrabromo-2,2',4,4',6,6'-hexafluorobiphenyl on Ag(111).
Lischka M , Michelitsch GS , Martsinovich N , Eichhorn J , Rastgoo-Lahrood A , Strunskus T , Breuer R , Reuter K , Schmittel M , Lackinger M .
Lischka M , et al. Among authors: michelitsch gs.
Nanoscale. 2018 Jul 5;10(25):12035-12044. doi: 10.1039/c8nr01987h.
Nanoscale. 2018.
PMID: 29905751
Free article.
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Surface-Mediated Ring-Opening and Porphyrin Deconstruction via Conformational Distortion.
Bischoff F, Riss A, Michelitsch GS, Ducke J, Barth JV, Reuter K, Auwärter W.
Bischoff F, et al. Among authors: michelitsch gs.
J Am Chem Soc. 2021 Sep 22;143(37):15131-15138. doi: 10.1021/jacs.1c05348. Epub 2021 Sep 2.
J Am Chem Soc. 2021.
PMID: 34472340
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