Sökning: "CrI3"

Hittade 1 uppsats innehållade ordet CrI3.

  1. 1. First Principles Studies Of 2D Magnets

    Kandidat-uppsats,

    Författare :Yahya Fayazi; Linus Jacobsson; Folke Gustafsson; [2022]
    Nyckelord :2D material; ab initio; magnet; Quantum Espresso; Density Functional Theory; DFT; CrCl3; CrBr3; CrI3; 2D material; 2 dimensionella material; två dimensionella material;

    Sammanfattning : The aim of this project is to examine the electric and magneticproperties of three monolayer chromium trihalides when doped withdifferent transitions metals, that is CrXY_6, where X=(Mn,Fe,Co,Ni,V)and Y=(Cl,Br,I). The calculations were made using the software programQuantum Espresso that used density functional theory to solveSchrödinger’s equation. LÄS MER