| HrZZ UIP-2019-04-6869 Study of phonon-assisted processes in quasi-two-dimensional materials |
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| project leader | |
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| associates | Fabio Caruso (Humboldt-Universität zu Berlin) | |
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| start date | 15.01.2020. |
| end date | 14.01.2025. |
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| total ammount | 1.497.000,00 kn |
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| research areas | Surface physics
Solid state physics
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Abstract
The main goal of the present project is to conduct a thorough theoretical study on the role the electron-phonon coupling in novel quasi-two-dimensional materials by using quantitative first-principles methods. The impact of the electron-phonon interaction on phonon and electron dynamics is planned to be studied under both equilibrium and nonequilibrium conditions, where energies of electron and lattice degrees of freedom are equal and mismatched, respectively. Specifically, we intend to investigate graphene-related materials, metallic and semiconductive versions of transition metal dichalcogenides, as well as some recently discovered two-dimensional materials like borophene. Each of these materials possesses unique optical properties highly desirable for applications in optoelectronic industry, which are ruled in parts by dynamical interplay between electrons and phonons. The corresponding theoretical output will be directly related to several spectroscopic techniques, like Raman, reflectivity, and photoemission measurements, as well as to their time-resolved versions, where nonequilibrium condition is achieved through ”pump-probe” methods. This renders the proposed study a potentially essential for complementing and elucidating the aforementioned experiments, but also for predicting novel physical features and thus encouraging future experimental work.
Publications
Borna Pielić*, Matko Mužević, Dino Novko, Jiaqi Cai, Alice Bremerich, Robin Ohmann,Marko Kralj, Iva Šrut Rakić* and Carsten BusseProbing the interplay of interactions, screening and strain in monolayer MoS2 via self-intercalation
npj 2D materials and applications 8:61 (2024)
DOI: 10.1038/s41699-024-00488-3 20240912
Cheng-Long Zhou, Zahra Torbatian, Shui-Hua Yang, Yong Zhang, Hong-Liang Yi, Mauro Antezza, Dino Novko, and Cheng-Wei QiuUnconventional Thermophotonic Charge Density Wave
Phys. Rev. Lett. 133, 066902 (2024)
DOI: 10.1103/PhysRevLett.133.066902 20240805
Zahra Torbatian, Dino NovkoPlasmon Excitations across the Charge-Density-Wave Transition in Single-Layer TiSe2
J. Phys. Chem. Lett. 15, 6045 (2024)
DOI: 10.1021/acs.jpclett.4c01034 20240531
Jan Berges, Nina Girotto, Tim Wehling, Nicola Marzari, and Samuel PoncéPhonon Self-Energy Corrections: To Screen, or Not to Screen
Phys. Rev. X 13, 041009 (2023)
DOI: 10.1103/PhysRevX.13.041009 20231017
N. Girotto, L. Linhart, and F. LibischCoupled phonons in twisted bilayer graphene
Phys. Rev. B 108, 155415 (2023)
DOI: 10.1103/PhysRevB.108.155415 20231012
Nina Girotto, Dino NovkoDynamical Phonons Following Electron Relaxation Stages in Photoexcited Graphene
J. Phys. Chem. Lett 14, 8709 (2023)
DOI: 10.1021/acs.jpclett.3c01905 20230921
Branko Gumhalter, Dino NovkoComplementary perturbative and nonperturbative pictures of plasmonically induced electron emission from flat metal surfaces
, Prog. Surf. Sci. 98, 100706 (2023)
DOI: 10.1016/j.progsurf.2023.100706 20230919
Nina Girotto, Fabio Caruso, Dino NovkoUltrafast Nonadiabatic Phonon Renormalization in Photoexcited Single-Layer MoS2
J. Phys. Chem. C 127, 16515 (2023)
DOI: 10.1021/acs.jpcc.3c03664 20230816
Raúl Bombín, A. S. Muzas, Dino Novko, J. Iñaki Juaristi, and Maite AlducinVibrational dynamics of CO on Pd(111) in and out of thermal equilibrium
Physical Review B 108, 045409 (2023)
DOI: 10.1103/PhysRevB.108.045409 20230717
Raúl Bombín, A. S. Muzas, Dino Novko, J. Iñaki Juaristi, and Maite AlducinAnomalous transient blueshift in the internal stretch mode of CO/Pd(111)
Physical Review B 107, L121404 (2023)
DOI: 10.1103/PhysRevB.107.L121404 20230310
Nina Girotto, Dino NovkoDynamical renormalization of electron-phonon coupling in conventional superconductors
Physical Review B 107, 064310 (2023)
DOI: 10.1103/PhysRevB.107.064310 20230227
Dino Novko, Zahra Torbatian, Ivor LončarićElectron correlations rule the phonon-driven instability in single-layer TiSe2
Physical Review B 106, 245108
DOI: 10.1103/PhysRevB.106.245108 20221207
Cheng-Long Zhou, Yong Zhang, Zahra Torbatian, Dino Novko, Mauro Antezza, and Hong-Liang YiPhoton tunneling reconstitution in black phosphorus/ h BN heterostructure
Physical Review Materials 6, 075201 (2022)
DOI: 10.1103/PhysRevMaterials.6.075201 20220726
Branko Gumhalter, Dino Novko, Hrvoje PetekElectron emission from plasmonically induced Floquet bands at metal surfaces
Phys. Rev. B 106, 035422 (2022)
DOI: 10.1103/PhysRevB.106.035422 20220725
Fabio Caruso, Dino NovkoUltrafast dynamics of electrons and phonons: from the two-temperature model to the time-dependent Boltzmann equation
Advances in Physics: X 7, 2095925 (2022)
DOI: 10.1080/23746149.2022.2095925 20220720
M. Düvel, M. Merboldt, J. P. Bange, H. Strauch, M. Stellbrink, K. Pierz, H. W. Schumacher, D. Momeni, D. Steil, G. S. M. Jansen, S. Steil, D. Novko, S. MathiasFar-from-Equilibrium Electron–Phonon Interactions in Optically Excited Graphene
Nano Letters 22, 4897 (2022)
DOI: 10.1021/acs.nanolett.2c01325 20220601
Emmanuele Cappelluti, Fabio Caruso, Dino NovkoProperties and challenges of hot-phonon physics in metals: MgB2 and other compounds
Progress in Surface Science 97, 100664 (2022)
DOI: 10.1016/j.progsurf.2022.100664 20220531
Emmanuele Cappelluti, Dino NovkoFingerprints of hot-phonon physics in time-resolved correlated quantum lattice dynamics
SciPost Phys. 12, 173 (2022)
DOI: 10.21468/SciPostPhys.12.5.173 20220524
Borna Radatović, Valentino Jadriško, Sherif Kamal, Marko Kralj, Dino Novko, Nataša Vujičić, and Marin PetrovićMacroscopic single-phase monolayer borophene on arbitrary substrates
ACS Applied Materials & Interfaces, 14, 18, 21727-21737, (2022)
DOI: 10.1021/acsami.2c03678 20220502
S. Tanaka, T. Yoshida, K. Watanabe, Y. Matsumoto, T. Yasuike, D. Novko, M. Petrović, M. KraljUltrafast Plasmonic Response Ensured by Atomic Scale Confinement
ACS Photonics. 9(3), 837–845 (2022)
DOI: 10.1021/acsphotonics.1c01454 20220320
Andi Li, Marcel Reutzel, Zehua Wang, David Schmitt, Marius Keunecke, Wiebke Bennecke, G. S. Matthijs Jansen, Daniel Steil, Sabine Steil, Dino Novko, Branko Gumhalter, Stefan Mathias, and Hrvoje PetekMultidimensional multiphoton momentum microscopy of the anisotropic Ag(110) surface
Physical Review B 105, 075105 (2022)
DOI: 10.1103/PhysRevB.105.075105 20220202
Cheng-Long Zhou, Zahra Torbatian, Xiao-Hu Wu, Yong Zhang, Hong-Liang Yi, Dino NovkoTunable Near-Field Radiative Effect in a Td–WTe2 Single Layer
Physical Review Applied 17, 014044 (2022).
DOI: 10.1103/PhysRevApplied.17.014044 20220131
Cheng-Long Zhou, Xiao-Hu Wu, Yong Zhang, Hong-Liang Yi, Dino NovkoNear-field thermal radiation of germanium selenide single layer
Physical Review Materials 5, 124005 (2021)
DOI: 10.1103/PhysRevMaterials.5.124005 20211216
D. Novko, K. Lyon, D. J. Mowbray, V. DespojaAb initio study of electromagnetic modes in two-dimensional semiconductors: Application to doped phosphorene
Physical Review B 104, 115421 (2021).
DOI: 10.1103/PhysRevB.104.115421 20210917
D. Novko, V. DespojaCavity exciton polaritons in two-dimensional semiconductors from first principles
Physical Review Research 3, L032056 (2021).
DOI: 10.1103/PhysRevResearch.3.L032056 20210903
Z. Torbatian, D. Novko, R. AsgariHyperbolic plasmon modes in tilted Dirac cone phases of borophene
Physical Review B 104, 075432 (2021)
DOI: 10.1103/PhysRevB.104.075432 20210818
D. Novko, V. Despoja, M. Reutzel, A. Li, H. Petek, and B. GumhalterPlasmonically assisted channels of photoemission from metals
Physical Review B 103, 205401 (2021).
DOI: 10.1103/PhysRevB.103.205401 20210503
D. NovkoFirst-principles study of ultrafast dynamics of Dirac plasmon in graphene
New Journal of Physics 23 , 043023 (2021).
DOI: 10.1088/1367-2630/abec0f 20210408
Christopher C. S. Chan, Kezhou Fan, Han Wang, Zhanfeng Huang, Dino Novko, Keyou Yan, Jianbin Xu, Wallace C. H. Choy, Ivor Lončarić, and Kam Sing WongUncovering the Electron-Phonon Interplay and Dynamical Energy-Dissipation Mechanisms of Hot Carriers in Hybrid Lead Halide Perovskites
Advanced Energy Materials 11, 2003071 (2021).
DOI: 10.1002/aenm.202003071 20210127
Zahra Torbatian, Mohammad Alidoosti, Dino Novko, and Reza AsgariLow-loss two-dimensional plasmon modes in antimonene
Physical Review B 101, 205412 (2020)
DOI: 10.1103/PhysRevB.101.205412 20200511
