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CMS Group@UNLV |
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Publications |
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Peer Reviewed Papers
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Boulfelfel SE, Zhu Q and Oganov AR (2012)
Novel sp3-forms of carbon predicted by evolutionary metadynamics and analysis of their synthesizability using transition path sampling.
J. Superhard Mater., 34, 350-359
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Zhou XF, Oganov AR, Qian GR and Zhu Q (2012)
First-principles determination of the structure of magnesium borohydride.
Phys. Rev. Lett. 109, 245503
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Zhu Q, Zeng Q, Oganov AR.(2012).
Systematic search for low-enthalpy sp(3) carbon allotropes using evolutionary metadynamics.
Phys. Rev. B 85, 201407
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Zhu Q, Oganov AR, Glass CW, Stokes H.(2012).
Constrained evolutionary algorithm for structure prediction of molecular crystals: methodology and applications.
Acta. Caryst. B68, 215-226
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Zhu Q., Oganov A.R. and Lyakhov A.O. (2012)
Evolutionary metadynamics: a novel method to predict crystal structures.
Cryst. Eng. Comm. 14, 3596-3601.
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