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The top documents tagged [ab initio study]
Artem R. Oganov- High-Pressure Crystallogaphy
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Ponencia en la ud
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Ab initio electronic structure of Alkali Borohydrides: An Ab Initio Study W. Gempel and N. Kioussis California State University Northridge D. Papaconstantopoulos
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The hydrophobic effect at supercooled temperatures: Ab initio study J. T. Titantah Department of Applied Mathematics University of Western Ontario M. Karttunen
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Conclusions The spin density surfaces of the antiferromagnetic ground states demonstrate opposite spins at the ends, and alternating spins along the length
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Ab initio study of the diffusion of Mn through GaN
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Ab Initio Study of the Hydrogenation of Mg with Incorporated Ti Atom on the Surface
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