研究目的
To propose a tentative modality of phase change spintronic devices based on the ferromagnet/PCM/ferromagnet structure and to calculate the electronic structures of the interfaces of c-Ge2Sb2Te5 and half-metallic ferromagnetic Co2FeX (X: Al, Si).
研究成果
The study proposes a tentative modality of phase change spintronic devices and provides useful insights for follow-up experiments. The electronic structures of c-Ge2Sb2Te5/Co2FeX interfaces are tunable by the substitution of main group element X, offering the toolbox for realizing functionalities as desired.
研究不足
None of the interfaces is genuine half-metallic, indicating room for improvement. The interface states fully occupying the band gap in the minority spin channel may degrade the spin injection efficiency.
1:Experimental Design and Method Selection:
First-principles calculations were performed to study the electronic structures of c-Ge2Sb2Te5/Co2FeAl and c-Ge2Sb2Te5/Co2FeSi interfaces using GGA + U method.
2:Sample Selection and Data Sources:
The atomic structure of crystalline cubic Ge2Sb2Te5 and the unit cell structures of Co2FeAl and Co2FeSi were relaxed by GGA functional in CASTEP.
3:List of Experimental Equipment and Materials:
Ultrasoft pseudopotentials and 330 eV cutoff energy were employed.
4:Experimental Procedures and Operational Workflow:
The interfaces were built supercell models for epitaxial interfaces of (0001) c-Ge2Sb2Te5/(111)Heusler-alloy by fixing the in-plane lattice parameters to those of c-Ge2Sb2Te
5:Data Analysis Methods:
The partial density of states (PDOSs) of a central Te atom in c-Ge2Sb2Te5 and the interfacial and central Co, Fe, and Al atoms in Co2FeAl were examined.
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