Calculation of electronic and structural properties of<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mi mathvariant="normal">BC</mml:mi></mml:mrow><mml:mrow><mml:mn>3</mml:mn></mml:mrow></mml:msub></mml:mrow></mml:math>
David Tománek(University of Johannesburg), Marvin L. Cohen(Lawrence Berkeley National Laboratory), Renata M. Wentzcovitch(Columbia University), Steven G. Louie(Lawrence Berkeley National Laboratory)
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