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Mott transition and superexchange mechanism in magnetically doped XSi2N4 caused by large 3d orbital onsite Coulomb interaction

The result's identifiers

  • Result code in IS VaVaI

    <a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F61989100%3A27740%2F22%3A10251636" target="_blank" >RIV/61989100:27740/22:10251636 - isvavai.cz</a>

  • Alternative codes found

    RIV/61989100:27640/22:10251636

  • Result on the web

    <a href="https://journals.aps.org/prb/abstract/10.1103/PhysRevB.106.104421" target="_blank" >https://journals.aps.org/prb/abstract/10.1103/PhysRevB.106.104421</a>

  • DOI - Digital Object Identifier

    <a href="http://dx.doi.org/10.1103/PhysRevB.106.104421" target="_blank" >10.1103/PhysRevB.106.104421</a>

Alternative languages

  • Result language

    angličtina

  • Original language name

    Mott transition and superexchange mechanism in magnetically doped XSi2N4 caused by large 3d orbital onsite Coulomb interaction

  • Original language description

    Magnetic two-dimensional materials have great potential in the preparation of nanoelectronic and spintronic devices. Recently, a new two-dimensional material with no corresponding bulk-structure, MoSi2N4, has been prepared, attracting public attention to the XA2Z4 series of materials. Naturally, doping with 3d magnetic element will result in various magnetic orderings. In our work, we replaced the Mo element with different transition-metal elements whose property varies from magnetic to nonmagnetic and screened out a variety of two-dimensional exchange scenarios. Then, we provided an analysis that shows the existence of a huge on-site Coulomb interaction at 3d orbitals which is strongly related to the Mott transition and therefore causes the superexchange interaction.

  • Czech name

  • Czech description

Classification

  • Type

    J<sub>imp</sub> - Article in a specialist periodical, which is included in the Web of Science database

  • CEP classification

  • OECD FORD branch

    10302 - Condensed matter physics (including formerly solid state physics, supercond.)

Result continuities

  • Project

    <a href="/en/project/EF16_013%2F0001791" target="_blank" >EF16_013/0001791: IT4Innovations national supercomputing center - path to exascale</a><br>

  • Continuities

    P - Projekt vyzkumu a vyvoje financovany z verejnych zdroju (s odkazem do CEP)

Others

  • Publication year

    2022

  • Confidentiality

    S - Úplné a pravdivé údaje o projektu nepodléhají ochraně podle zvláštních právních předpisů

Data specific for result type

  • Name of the periodical

    Physical review B

  • ISSN

    2469-9950

  • e-ISSN

    2469-9969

  • Volume of the periodical

    106

  • Issue of the periodical within the volume

    10

  • Country of publishing house

    US - UNITED STATES

  • Number of pages

    9

  • Pages from-to

    104421

  • UT code for WoS article

    000861562000002

  • EID of the result in the Scopus database

    2-s2.0-85139341423