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- Title
Quantum capacitance of quasi-2D-crystals.
- Authors
Lukiyanets, Bohdan A.; Matulka, Dariia V.
- Abstract
Results of research in the quantum capacitance C q of quasi-2D-crystals are presented. The detected extraordinary behavior of C q manifests itself in the existence of such energy ranges in which it is practically equal to zero. The causes for the existence of such ranges are: (a) dimensional quantization as a result of the nanoscale of the van der Waals gap, (b) a certain value of the width of the allowed zone in the plane of the layers, which is determined by the value of the effective mass. Intercalation and external electric field are effective factors capable of changing the position of ranges. Thus, in a system connected in a series of electrostatic and quantum capacitances, the resulting capacitance will significantly depend on the C q behavior. Comparative analyses of structures, chemical bonds, majority of coinciding characteristics of physical quantities in graphite, transition metal dichalcogenides (TMD), and layered crystals A3B6 allow us to assert that the obtained qualitative conclusions can be applied for each of them. Calculations of density of states (DOS) of quasi-2D crystals performed by authors within the framework of the improved Kohn–Sham density functional theory (DFT), namely the DFT taking into account the van der Waals forces in it, show a step-like form of DOS qualitatively similar to ours.
- Subjects
VAN der Waals forces; DENSITY functional theory; ELECTRIC fields; DENSITY of states; TRANSITION metals; CHEMICAL bonds
- Publication
International Journal of Modern Physics B: Condensed Matter Physics; Statistical Physics; Applied Physics, 2024, Vol 38, Issue 22, p1
- ISSN
0217-9792
- Publication type
Article
- DOI
10.1142/S0217979224502904