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Ab Initio Calculations in a Uniform Magnetic Field Using Periodic Supercells

✍ Scribed by Cai, Wei; Galli, Giulia


Book ID
118749894
Publisher
The American Physical Society
Year
2004
Tongue
English
Weight
207 KB
Volume
92
Category
Article
ISSN
0031-9007

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Electronic structure calculations in a u
✍ Eunseok Lee; Wei Cai; Giulia A. Galli πŸ“‚ Article πŸ“… 2007 πŸ› Elsevier Science 🌐 English βš– 523 KB

We have recently presented a method that allows one to use periodic supercells in ab initio electronic structure calculations in the presence of a finite magnetic field [Phys. Rev. Lett. 92 (2004) 186402]. This method retains the simplicity and efficiency of plane-wave basis sets and Fourier transfo