A Novel Topological Compression Mechanism in a Covalent Liquid
Monte Carlo simulations of tetrahedrally bonded SiO$_2$ liquid show that pressure induces large changes in the topology of its four-coordinated framework structure but leaves the average properties of local coordination environments virtually unchanged. Ring statistics are used to describe the liqui...
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Veröffentlicht in: | Science (American Association for the Advancement of Science) 1990-10, Vol.250 (4980), p.541-543 |
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Hauptverfasser: | , |
Format: | Artikel |
Sprache: | eng |
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Zusammenfassung: | Monte Carlo simulations of tetrahedrally bonded SiO$_2$ liquid show that pressure induces large changes in the topology of its four-coordinated framework structure but leaves the average properties of local coordination environments virtually unchanged. Ring statistics are used to describe the liquid's topology; the observed changes paradoxically indicate that the liquid compresses primarily by increasing the size of its rings. A theory for the effects of ring formation on density, which also explains the density of crystalline tectosilicates, accounts for the compression of the liquid. |
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ISSN: | 0036-8075 1095-9203 |
DOI: | 10.1126/science.250.4980.541 |