• Room LG.023 - New Physics

    United Kingdom

Accepting PhD Students

PhD projects

Research projects are available in the field of theoretical spectroscopy of crystalline solids, nanostructures, interfaces and 2D materials. Projects imply both the use of existing approaches and computational tools to predict spectroscopic properties of materials and the development of novel approaches and computational tools. Approaches and computational tools are based on density-functional theory and many-body perturbation theory (GW approximation, Bethe-Salpeter equation). For availability of funded PhD project check: https://titus.phy.qub.ac.uk/category/opportunities/

20012020

Research output per year

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Projects

Research Output

Role of the lattice in the light-induced insulator-to-metal transition in vanadium dioxide

Weber, C., Acharya, S., Cunningham, B., Grüning, M., Zhang, L., Zhao, H., Tan, S-Y., Zhang, Y., Zhang, C., Liu, K., van Schilfgaarde, M. & Shalaby, M., 24 Apr 2020, In : Physical Review Research. 2, 6 p., 023076.

Research output: Contribution to journalArticle

Open Access
File
  • 5 Downloads (Pure)

    Engineering the Interfacial Electronic Structure of Epitaxial Ge/AlAs(001) Heterointerfaces via Substitutional Boron Incorporation: The Roles of Doping and Interface Stoichiometry

    Clavel, M. B., Greene-Diniz, G., Grüning, M., Henry, K. T., Kuhn, M., Bodnar, R. J. & Hudait, M. K., 24 Dec 2019, In : ACS Applied Electronic Materials . 1, 12, p. 2646-2654

    Research output: Contribution to journalArticle

  • Many-body perturbation theory calculations using the yambo code

    Sangalli, D., Gruening, M., Cannuccia, E., Attaccalite, C., Marini, A., Hogan, C., Varsano, D. & Ferretti, A., 29 May 2019, In : Journal of Physics: Condensed Matter. 31, 31 p.

    Research output: Contribution to journalArticle

    Open Access
    File
  • 21 Citations (Scopus)
    91 Downloads (Pure)

    Possible phonon-induced electronic bi-stability in VO2 for ultrafast memory at room temperature

    Tan, Y., Zhao, H., Yan, L. Z., Zhang, L., Zhang, Y., Weber, C., Acharya, S., Cunningham, B., Gruning, M., Liu, K., Schilfgaarde, M. V. & Shalaby, M., 21 Oct 2019, IRMMW-THz 2019 - 44th International Conference on Infrared, Millimeter, and Terahertz Waves: Proceedings. IEEE Computer Society, 8874246. (International Conference on Infrared, Millimeter, and Terahertz Waves, IRMMW-THz; vol. 2019-September).

    Research output: Chapter in Book/Report/Conference proceedingConference contribution

  • 1 Citation (Scopus)

    Second-harmonic generation in single-layer monochalcogenides: A response from first-principles real-time simulations

    Attaccalite, C., Palummo, M., Cannuccia, E. & Grüning, M., 16 Jul 2019, In : Physical Review Materials. 3, 7 p., 074003.

    Research output: Contribution to journalArticle

    Open Access
    File
  • 1 Citation (Scopus)
    144 Downloads (Pure)

    Activities

    23rd Workshop on Electronic Excitations

    Myrta Grüning (Contributor)
    10 Sep 201814 Sep 2018

    Activity: Participating in or organising an event typesParticipation in conference

    Workgroup co-leader - COST CA17126

    Myrta Grüning (Vice-Chair)
    2018 → …

    Activity: Consultancy typesContribution to the work of national or international committees and working groups

    Physics Department Durham University

    Myrta Grüning (Invited speaker)
    12 Dec 2018

    Activity: Talk or presentation typesInvited talk

    European Theoretical Spectroscopy Facility Steering Committee

    Myrta Grüning (Member)
    20182021

    Activity: Consultancy typesContribution to the work of national or international committees and working groups

    Theory Days

    Myrta Grüning (Invited speaker)
    28 Nov 201830 Nov 2018

    Activity: Talk or presentation typesInvited or keynote talk at national or international conference

    Thesis

    Ab Initio Modelling of Photoinduced Electron Dynamics in Nanostructures

    Author: McMillan, R. J., 04 Nov 2017

    Supervisor: Gruening, M. (Supervisor) & Dundas, D. (Supervisor)

    Student thesis: Doctoral ThesisDoctor of Philosophy

    File