• Publikationen

    2021

    • H. Osthues, C. Schwermann, J.A. Preuß, T. Deilmann, R. Bratschitsch, M. Rohlfing, and N.L. Doltsinis
      Covalent photofunctionalization and electronic repair of 2H-MoS2 via nitrogen incorporation
      Phys. Chem. Chem. Phys. 23, 18517 (2021)
    • M.N. Gjerding, A. Taghizadeh, A. Rasmussen, S. Ali, F. Bertoldo, T. Deilmann, N. Knøsgaard, M. Kruse, A.H. Larsen, S. Manti, T.G. Pedersen, U. Petralanda, T. Skovhus, M.K. Svendsen, J.J. Mortensen, T. Olsen, and K.S. Thygesen
      Recent Progress of the Computational 2D Materials Database (C2DB)
      2D Mater. 8, 044002 (2021)
    • N. Peimyoo, T. Deilmann, F. Withers, J. Escolar, D. Nutting, T. Taniguchi, K. Watanabe, A. Taghizadeh, M.F. Craciun, K.S. Thygesen, and S. Russo
      Electrical tuning of optically active interlayer excitons in bilayer MoS2
      Nature Nanotechnology 16, 888-893 (2021)
    • M.-C. Heißenbüttel, T. Deilmann, P. Krüger, and M. Rohlfing
      Valley-Dependent Interlayer Excitons in Magnetic WSe2/CrI3
      Nano Lett. 21, 5173-5178 (2021)
    • J. Tölle, T. Deilmann, M. Rohlfing, and J. Neugebauer
      Subsystem-Based GW/Bethe-Salpeter Equation
      J. Chem. Theory Comput. 17, 2186 (2021)
    • A. Rasmussen, T. Deilmann, K.S. Thygesen
      Towards fully automatized GW band structure calculations: What can we learn from 60.000 self-energy evaluations
      npj Computational Materials 7, Article number: 22 (2021)

    2020

    • V. Jindal, D. Jana, T. Deilmann, and S. Ghosh
      Interlayer and excited-state exciton transitions in bulk 2H-MoS2
      Phys. Rev. B 102, 235204 (2020)
    • I. Niehues, P. Marauhn, T. Deilmann, D. Wigger, R. Schmidt, A. Arora, S. Michaelis de Vasconcellos, Michael Rohlfing and R. Bratschitsch
      Strain tuning of the Stokes shift in atomically thin semiconductors
      Nanoscale 12, 20786 (2020)
    • A. Arora, N.K. Wessling, T. Deilmann, T. Reichenauer, P. Steeger, P. Kossacki, M. Potemski, S. Michaelis de Vasconcellos, M. Rohlfing, and R. Bratschitsch
      Dark trions govern the temperature-dependent optical absorption and emission of doped atomically thin semiconductors
      Phys. Rev. B 101, 241413(R) (2020)
    • T. Deilmann, P. Krüger, and M. Rohlfing
      Ab initio studies of exciton g factors: Monolayer transition metal dichalcogenides in magnetic fields
      Phys. Rev. Lett. 124, 226402 (2020)
    • T. Deilmann, M. Rohlfing, und U. Wurstbauer
      Light-matter interaction in van der Waals heterostructures
      J. Phys.: Condens. Matter 32, 333002 (2020)
    • F. Eickhoff, E. Kolodzeiski, T. Esat, N. Fournier, C. Wagner, T. Deilmann, R. Temirov, M. Rohlfing, F.S. Tautz, and F.B. Anders
      Inelastic electron tunneling spectroscopy for probing strongly correlated many-body systems by scanning tunneling microscopy
      Phys. Rev. B 101, 125405 (2020)
    • T. Deilmann
      Valley selectivity induced by magnetic adsorbates: Triplet oxygen on monolayer MoS2
      Phys. Rev. B 101, 085130 (2020)

    2019

    • S. Haastrup, M. Strange, M. Pandey, T. Deilmann, P.S. Schmidt, N.F. Hinsche, M.N. Gjerding, D. Torelli, P.M. Larsen, A.C. Riis-Jensen
      Reply to comment on 'The Computational 2D Materials Database: high-throughput modeling and discovery of atomically thin crystals'
      2D Mater. 6, 048001 (2019)
    • A. Arora, T. Deilmann, T. Reichenauer, J. Kern, S. Michaelis de Vasconcellos, M. Rohlfing, and R. Bratschitsch
      Excited-State Trions in Monolayer WS2
      Phys. Rev. Lett. 123, 167401 (2019)
    • A.C. Riis-Jensen, T. Deilmann, T. Olsen and K.S. Thygesen
      Classifying the Electronic and Optical Properties of Janus Monolayers
      ACS Nano 2019, 13, 13354-13364
    • T. Deilmann and K.S. Thygesen
      Finite-momentum exciton landscape in mono- and bilayer transition metal dichalcogenides
      2D Mater. 6, 035003 (2019)
    • T. Olsen, E. Andersen, T. Okugawa, D. Torelli, T. Deilmann, and K.S. Thygesen
      Discovering two-dimensional topological insulators from high-throughput computations
      Phys. Rev. Materials 3, 024005 (2019)
    • T. Deilmann and K.S. Thygesen
      Important role of screening the electron-hole exchange interaction for the optical properties of molecules near metal surfaces
      Phys. Rev. B 99, 045133 (2019)
    • M.-C. Heissenbüttel, P. Marauhn, T. Deilmann, P. Krüger, and M. Rohlfing
      Nature of the excited states of layered systems and molecular excimers: Exciplex states and their dependence on structure
      Phys. Rev. B 99, 035425 (2019)

    2018

    • M. Drüppel, T. Deilmann, J. Noky, P. Marauhn, P. Krüger, and M. Rohlfing
      Electronic excitations in transition metal dichalcogenide monolayers from an LDA+GdW approach
      Phys. Rev. B 98, 155433 (2018)
    • T. Deilmann
      Trions in bulk LiF and at the LiF(001) surface
      Phys. Rev. B 98, 165105 (2018)
    • S. Haastrup, M. Strange, M. Pandey, T. Deilmann, P.S. Schmidt, N.F. Hinsche, M.N. Gjerding, D. Torelli, P.M. Larsen, A.C. Riis-Jensen, J. Gath, K.W. Jacobsen, J.J. Mortensen, T. Olsen, and K.S. Thygesen
      The Computational 2D Materials Database: high-throughput modeling and discovery of atomically thin crystals
      2D Mater. 5, 042002 (2018)
    • T. Deilmann and K.S. Thygesen
      Unraveling the not-so-large trion binding energy in monolayer black phosphorus
      2D Mater. 5, 041007 (2018)
    • T. Deilmann and K.S. Thygesen
      Interlayer Excitons with Large Optical Amplitudes in Layered van der Waals Materials
      Nano Lett. 18, 2984 (2018)
    • T. Deilmann and K.S. Thygesen
      Interlayer Trions in the MoS2/WS2 van der Waals Heterostructure
      Nano Lett. 18, 1460 (2018)
    • V. Jindal, S. Bhuyan, T. Deilmann, and S. Ghosh
      Anomalous behavior of the excited state of the A exciton in bulk WS2
      Phys. Rev. B 97, 045211 (2018)
    • A. Arora, T. Deilmann, P. Marauhn, M. Drüppel, R. Schneider, M. R. Molas, D. Vaclavkova, S. Michaelis de Vasconcellos, M. Rohlfing, M. Potemski, and R. Bratschitsch
      Valley-contrasting optics of interlayer excitons in Mo- and W-based bulk transition metal dichalcogenides
      Nanoscale 10, 15571 (2018)

    2017

    • M. Drüppel, T. Deilmann, P. Krüger, and M. Rohlfing
      Diversity of trion states and substrate effects in the optical properties of an MoS2 monolayer
      Nat. Comm. 8, 2117 (2017)
    • T. Deilmann and K.S. Thygesen
      Dark excitations in monolayer transition metal dichalcogenides
      Phys. Rev. B 96, 201113 (2017)
    • T. Deilmann and M. Rohlfing
      Huge Trionic Effects in Graphene Nanoribbons
      Nano Lett. 17, 6833 (2017)
    • A. Arora, M. Drüppel, R. Schmidt, T. Deilmann, M.R. Molas, P. Marauhn, S. Michaelis de Vasconcellos, M. Potemski, M. Rohlfing, and R. Bratschitsch
      Interlayer excitons in a bulk van der Waals semiconductor
      Nat. Comm. 8, 639 (2017)
      [Publisher Correction]
    • A. Arora, J. Noky, M. Drüppel, B. Jariwala, T. Deilmann, R. Schneider, R. Schmidt, O. Del Pozo-Zamudio, T. Stiehm, A. Bhattacharya, P. Krüger, S. Michaelis de Vasconcellos, M. Rohlfing, and R. Bratschitsch
      Highly Anisotropic in-Plane Excitons in Atomically Thin and Bulklike 1T'-ReSe2
      Nano Lett. 17, 3202 (2017)
      [Addition/Correction]

    2016

    2015

    • C. Wagner, M.F.B. Green, P. Leinen, T. Deilmann, P. Krüger, M. Rohlfing, R. Temirov, and F.S. Tautz
      Scanning Quantum Dot Microscopy
      Phys. Rev. Lett. 115, 026101 (2015)
    • T. Esat, T. Deilmann, B. Lechtenberg, C. Wagner, P. Krüger, R. Temirov, F. Anders, M. Rohlfing, and F. Tautz
      Transfering spin into an extended π orbital of a large molecule
      Phys. Rev. B 91, 144415 (2015)

    2014

    • T. Deilmann, P. Krüger, M. Rohlfing, and D. Wegner
      Adsorption and STM imaging of tetracyanoethylene on Ag(001): An ab initio study
      Phys. Rev. B 89, 045405 (2014)

  • Abschlussarbeiten

    • Structural, electronic and optical properties of organic adsorbates and further nanomaterials
      [Dissertation, 2015]
    • Ab-initio Studien von V-TCNE auf Ag(001)
      [Masterarbeit, 2012]
    • Ab-initio Berechnung der Kraft auf die Tunnelspitze in einem Rasterkraftmikroskop
      [Bachelorarbeit, 2010]