General First-Principles Approach to Crystals in Finite Magnetic Fields.
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DOI: 10.1103/74bb-qmp8
Abstract: We introduce a general first-principles methodology for computing electronic structure in a finite uniform magnetic field that allows for an arbitrary rational magnetic flux and nonlocal pseudopotentials at a comparable time complexity to conventional plane-wave… read more here.
Keywords: crystals finite; general first; principles approach; first principles ... See more keywords