Theoretical Atomic-scale Physics

  1. 2018
  2. Published

    Anomalous behavior of the excited state of the A exciton in bulk WS2. / Jindal, Vishwas; Bhuyan, Sumi; Deilmann, Thorsten; Ghosh, Sandip.

    In: Physical Review B, Vol. 97, No. 4, 045211, 2018.

    Publication: Research - peer-reviewJournal article – Annual report year: 2018

  3. Published

    Benchmark Database of Transition Metal Surface and Adsorption Energies from Many-Body Perturbation Theory. / Schmidt, Per Simmendefeldt; Thygesen, Kristian Sommer.

    In: Journal of Physical Chemistry C, Vol. 122, No. 8, 2018, p. 4381-4390.

    Publication: Research - peer-reviewJournal article – Annual report year: 2018

  4. Published

    clean energy materials innovation challenge. / Vegge, Tejs; Thygesen, Kristian Sommer; Aspuru-Guzik, Alan.

    Accelerating the clean energy revolution - perspectives on innovation challenges: DTU International Energy Report 2018. Technical University of Denmark (DTU), 2018. p. 81-88.

    Publication: Research - peer-reviewReport chapter – Annual report year: 2018

  5. Published

    Computational Screening of Light-absorbing Materials for Photoelectrochemical Water Splitting. / Castelli, Ivano E.; Kuhar, Korina; Pandey, Mohnish; Jacobsen, Karsten W.

    Advances in Photoelectrochemical Water Splitting : Theory, Experiment and Systems Analysis. Royal Society of Chemistry, 2018. p. 62-99.

    Publication: Research - peer-reviewBook chapter – Annual report year: 2018

  6. Published

    Dissociation of two-dimensional excitons in monolayer WSe2. / Massicotte, Mathieu; Vialla, Fabien; Schmidt, Peter ; Lundeberg, Mark B.; Latini, Simone; Haastrup, Sten; Danovich, Mark; Davydovskaya, Diana; Watanabe, Kenji; Taniguchi, Takashi; Fal'ko, Vladimir I.; Thygesen, Kristian Sommer; Pedersen, Thomas G.; Koppens, Frank H.L.

    In: Nature Communications, Vol. 9, No. 1, 1633, 2018.

    Publication: Research - peer-reviewJournal article – Annual report year: 2018

  7. Published

    Electron–phonon interaction and transport properties of metallic bulk and monolayer transition metal dichalcogenide TaS2. / Hinsche, Nicki Frank; Thygesen, Kristian Sommer.

    In: 2D materials, Vol. 5, No. 1, 015009 , 2018.

    Publication: Research - peer-reviewJournal article – Annual report year: 2018

  8. Published

    Exploration versus Exploitation in Global Atomistic Structure Optimization. / Jorgensen, Mathias S.; Larsen, Uffe F.; Jacobsen, Karsten Wedel; Hammer, Bjørk.

    In: Journal of Physical Chemistry Part A: Molecules, Spectroscopy, Kinetics, Environment and General Theory, Vol. 122, No. 5, 2018, p. 1504-1509.

    Publication: Research - peer-reviewJournal article – Annual report year: 2018

  9. Published
  10. Published

    Interlayer Excitons with Large Optical Amplitudes in Layered van der Waals Materials. / Deilmann, Thorsten; Thygesen, Kristian Sommer.

    In: Nano Letters, Vol. 18, No. 5, 2018, p. 2984-2989.

    Publication: Research - peer-reviewJournal article – Annual report year: 2018

  11. Published

    Interlayer Trions in the MoS2/WS2 van der Waals Heterostructure. / Deilmann, Thorsten; Thygesen, Kristian Sommer.

    In: Nano Letters, Vol. 18, No. 2, 2018, p. 1460-1465.

    Publication: Research - peer-reviewJournal article – Annual report year: 2018

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