Gd adsorption graphene nanobelt system with Rashba effect
A graphene nanoribbon and graphene technology, applied in the field of spintronics, can solve the problems of the possibility of material selection and the limitation of crystal growth technology
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[0040] In order to make the technical purpose, technical solution and beneficial effect of the present invention clearer, the technical solution of the present invention will be further described below in conjunction with the drawings and specific embodiments.
[0041] A Gd adsorption graphene nanoribbon system with Rashba effect is designed by the following method:
[0042] (1) Construct the graphene periodic cell in the Materials Studio software. The graphene cell contains 2 carbon atoms, and then the graphene cell is expanded along the x, y and z directions to construct the graphene cell. 4×4×1 graphene unit cell;
[0043] (2) Use the density functional theory that can be realized by the VASP software package to perform calculations. The exchange-correlation functional uses the GGA-PBE functional; the interaction between electrons and ions is described by the method of projection plus wave, and the plane wave cut-off energy is set to 450eV , the valence electron of Gd elem...
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