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Structural properties of liquid Al2O3: A molecular dynamics study
Uppsala University, Teknisk-naturvetenskapliga vetenskapsområdet, Physics, Department of Physics.
2000 (English)In: PHYSICAL REVIEW E, ISSN 1063-651X, Vol. 61, no 3, 2723-2729 p.Article in journal (Refereed) Published
Abstract [en]

Molecular dynamics (MD) simulations of liquid aluminum oxide (Al2O3) were carried out on a system with up to 1800 particles, using a pairwise potential. All simulations were done in the microcanonical ensemble, for two densities, 3.0 and 3.175 g/cm(3), at

Place, publisher, year, edition, pages
AMERICAN PHYSICAL SOC , 2000. Vol. 61, no 3, 2723-2729 p.
Keyword [en]
ALUMINUM-OXIDE; SYSTEM CAO-MGO-AL2O3-SIO2; GAMMA-ALUMINA; BULK MODULI; SIMULATION; TRANSFORMATION; POLYMORPHS; PRESSURE
Identifiers
URN: urn:nbn:se:uu:diva-36965OAI: oai:DiVA.org:uu-36965DiVA: diva2:64864
Note
Addresses: Gutierrez G, Univ Uppsala, Condensed Matter Theory Grp, Dept Phys, Box 530, S-75121 Uppsala, Sweden. Univ Uppsala, Condensed Matter Theory Grp, Dept Phys, S-75121 Uppsala, Sweden.Available from: 2008-10-17 Created: 2008-10-17 Last updated: 2011-01-14

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