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Probe Type II Band Alignment in One-Dimensional Van Der Waals Heterostructures Using First-Principles Calculations
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Calculation of zero-field splitting parameters: comparison of a two-component noncolinear spin-density-functional

Roman Reviakine1, Alexei V Arbuznikov, Jean-Christophe Tremblay

  • 1Institut für Anorganische Chemie, Universität Würzburg, Am Hubland, D-97074 Würzburg, Germany.

The Journal of Chemical Physics
|September 1, 2006
PubMed

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