ST2 model of water: Difference between revisions
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'''ST2''' is a [[Models |model]] for [[Computer simulation techniques |simulations]] of [[water]] <ref>[http://dx.doi.org/10.1063/1.1681229 Frank H. Stillinger and Aneesur Rahman "Improved simulation of liquid water by molecular dynamics", Journal of Chemical Physics '''60''' pp. 1545-1557 (1974)]</ref>. The ST2 model is based on the earlier Ben-Naim and Stillinger model, known as the [[Ben-Naim models of water |BNS model]]. | '''ST2''' is a [[Models |model]] for [[Computer simulation techniques |simulations]] of [[water]] <ref>[http://dx.doi.org/10.1063/1.1681229 Frank H. Stillinger and Aneesur Rahman "Improved simulation of liquid water by molecular dynamics", Journal of Chemical Physics '''60''' pp. 1545-1557 (1974)]</ref>. The ST2 model is based on the earlier Ben-Naim and Stillinger model, known as the [[Ben-Naim models of water |BNS model]]. | ||
==Parameters== | ==Parameters== | ||
==Temperature of maximum density== | |||
See: [[Liquid phase density maximum#Water | a table of water TMD values]]. | |||
==Liquid-liquid critical point== | ==Liquid-liquid critical point== | ||
Liu, Panagiotopoulos, and Debenedetti | Liu, Panagiotopoulos, and Debenedetti | ||
Revision as of 18:25, 16 September 2009
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ST2 is a model for simulations of water [1]. The ST2 model is based on the earlier Ben-Naim and Stillinger model, known as the BNS model.
Parameters
Temperature of maximum density
See: a table of water TMD values.
Liquid-liquid critical point
Liu, Panagiotopoulos, and Debenedetti [2] have located the critical point of the liquid-liquid transition to be at a temperature of , a density of and a pressure of .
References
- ↑ Frank H. Stillinger and Aneesur Rahman "Improved simulation of liquid water by molecular dynamics", Journal of Chemical Physics 60 pp. 1545-1557 (1974)
- ↑ Yang Liu, Athanassios Z. Panagiotopoulos, and Pablo G. Debenedetti "Low-temperature fluid-phase behavior of ST2 water", Journal of Chemical Physics 131 104508 (2009)
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