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Tran Doan Huan,1 Vu Ngoc Tuoc,2 Nam Ba Le,2,3 Nguyen Viet Minh,2 and Lilia M. Woods3,* 1Department of Materials Science & Engineering and Institute of Materials Science, University of Connecticut, 97 North Eagleville Road, Unit 3136, Storrs, Connecticut 06269-3136, USA 2Institute of Engineering Physics, Hanoi University of Science and Technology, 1 Dai Co Viet Road, Hanoi 1, Vietnam 3Department of Physics, University of South Florida, 4202 E. Fowler Avenue, Tampa, Florida 33620, USA (Received 22 September 2015; revised manuscript received 4 March 2016; published 22 March 2016)

physical review. b./physical review. b

High-pressure phases of<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML"><mml:mrow><mml:msub><mml:mi>Mg</mml:mi><mml:mn>2</mml:mn></mml:msub><mml:mi>Si</mml:mi></mml:mrow></mml:math>from first principles

High-pressure phases ofMg2Sifrom first principles