High-pressure behaviour of GeO2: a simulation study.

In this work we study the high-pressure behaviour of liquid and glassy GeO(2) by means of molecular dynamics simulations. The interaction potential, which includes dipole polarization effects, was parametrized using first-principles calculations. Our simulations reproduce the most recent experimenta...

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Sonraí bibleagrafaíochta
Príomhchruthaitheoirí: Marrocchelli, D, Salanne, M, Madden, P
Formáid: Journal article
Teanga:English
Foilsithe / Cruthaithe: 2010