Density anomaly as a function of tetrahedrality and bond angle in Stillinger-Weber potential

Conference item

Thermodynamic anomalies have been highly-debated topics over the last decades, especially in the water community. However, the anomalies appear in many systems of broad technological or biological interest that are constructed from tetrahedral building blocks. In this work we use molecular dynamics to study thermodynamic anomalies in Stillinger-Weber (SW) liquids. We employ a systematic approach to explore how the structure of the liquid changes the anomalous behaviour. We change the liquid s...

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Authors: Fijan, D; Wilson, M

• Publication status: Published
• Peer review status: Peer reviewed
• Publisher: Society of Physical Chemists of Serbia Publisher's website
• Host title: 14th International Conference on Fundamental and Applied Aspects of Physical Chemistry, Physical Chemistry 2018, 24–28 September 2018, Belgrade, Proceedings
• Volume: 2
• Pages: 711-714
• Publication date: 2018-09-06
• Acceptance date: 2018-06-16
• Event title: Physical Chemistry 2018
• Event location: Belgrade, Serbia
• Event website: http://www.socphyschemserb.org/en/events/pc2018
• Event start date: 2018-09-24
• Event end date: 2018-09-28
• ISBN: 978-86-82475-37-8
• Language: English