XTRANS: An electron transport package for current distribution and magnetic field in helical nanostructures
Computational Materials Science(2014)
摘要
•We develop an algorithm applying NEGF approach on helical symmetry.•Using helical symmetry may shrink volume of computation dramatically.•An approach for magnetic field and inductance based on “bond current” is proposed.•The magnetic field and inductance of carbyne and wrapped GNR is calculated.
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关键词
Electron transport,Magnetic field,Helical symmetry,Non-equilibrium Green’s function
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