ST2 model of water - Revision history

Carl McBride: /* References */ Added a recent publication

2018-07-09T08:52:48Z

References: Added a recent publication

← Older revision		Revision as of 10:52, 9 July 2018
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	*[http://dx.doi.org/10.1103/PhysRevLett.106.115706 Megan J. Cuthbertson and Peter H. Poole "Mixturelike Behavior Near a Liquid-Liquid Phase Transition in Simulations of Supercooled Water", Physical Review Letters '''106''' 115706 (2011)]		*[http://dx.doi.org/10.1103/PhysRevLett.106.115706 Megan J. Cuthbertson and Peter H. Poole "Mixturelike Behavior Near a Liquid-Liquid Phase Transition in Simulations of Supercooled Water", Physical Review Letters '''106''' 115706 (2011)]
	*[http://dx.doi.org/10.1063/1.4775738 Peter H. Poole, Richard K. Bowles, Ivan Saika-Voivod, and Francesco Sciortino "Free energy surface of ST2 water near the liquid-liquid phase transition", Journal of Chemical Physics '''138''' 034505 (2013)]		*[http://dx.doi.org/10.1063/1.4775738 Peter H. Poole, Richard K. Bowles, Ivan Saika-Voivod, and Francesco Sciortino "Free energy surface of ST2 water near the liquid-liquid phase transition", Journal of Chemical Physics '''138''' 034505 (2013)]
			*[https://doi.org/10.1080/00268976.2018.1442595 Jingxiang Guo, Rakesh S. Singh and Jeremy C. Palmer "Anomalous scattering in supercooled ST2 water", Molecular Physics '''116''' pp. 1953-1964 (2018)]


	[[category: water]]		[[category: water]]
	[[category: models]]		[[category: models]]

Carl McBride: Added a recent publication

2015-11-25T16:13:38Z

Added a recent publication

← Older revision		Revision as of 18:13, 25 November 2015
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	<ref>[http://dx.doi.org/10.1063/1.4769126 Yang Liu, Jeremy C. Palmer, Athanassios Z. Panagiotopoulos, and Pablo G. Debenedetti "Liquid-liquid transition in ST2 water", Journal of Chemical Physics '''137''' 214505 (2012)]</ref>		<ref>[http://dx.doi.org/10.1063/1.4769126 Yang Liu, Jeremy C. Palmer, Athanassios Z. Panagiotopoulos, and Pablo G. Debenedetti "Liquid-liquid transition in ST2 water", Journal of Chemical Physics '''137''' 214505 (2012)]</ref>
	to be at a [[temperature]] of <math>T_c = 237 \pm 4 ~\mathrm{K}</math>, a [[density]] of <math>\rho_c = 0.99 \pm 0.02 ~\mathrm{g/cm}^3</math> and a [[pressure]] of <math>p_c = 167 \pm 24 ~\mathrm{MPa}</math>. This finding is supported in the work of Sciortino, Saika-Voivod and Poole <ref>[http://dx.doi.org/10.1039/C1CP22316J Francesco Sciortino, Ivan Saika-Voivod and Peter H. Poole "Study of the ST2 model of water close to the liquid–liquid critical point", Phys. Chem. Chem. Phys. '''13''' pp. 19759-19764 (2011)]</ref>.		to be at a [[temperature]] of <math>T_c = 237 \pm 4 ~\mathrm{K}</math>, a [[density]] of <math>\rho_c = 0.99 \pm 0.02 ~\mathrm{g/cm}^3</math> and a [[pressure]] of <math>p_c = 167 \pm 24 ~\mathrm{MPa}</math>. This finding is supported in the work of Sciortino, Saika-Voivod and Poole <ref>[http://dx.doi.org/10.1039/C1CP22316J Francesco Sciortino, Ivan Saika-Voivod and Peter H. Poole "Study of the ST2 model of water close to the liquid–liquid critical point", Phys. Chem. Chem. Phys. '''13''' pp. 19759-19764 (2011)]</ref>.
			==Phase diagram==
			<ref>[http://dx.doi.org/10.1080/00268976.2015.1043966 Frank Smallenburg, Peter H. Poole and Francesco Sciortino "Phase diagram of the ST2 model of water", Molecular Physics '''113''' pp. 2791-2798 (2015)]</ref>.
	==References==		==References==
	<references/>		<references/>

Carl McBride: /* Liquid-liquid critical point */ Added a recent publication

2014-06-23T12:33:29Z

Liquid-liquid critical point: Added a recent publication

← Older revision		Revision as of 14:33, 23 June 2014
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	See: [[Liquid phase density maximum#Water \| a table of water TMD values]].		See: [[Liquid phase density maximum#Water \| a table of water TMD values]].
	==Liquid-liquid critical point==		==Liquid-liquid critical point==
			The ST2 model has a [[Liquid-liquid phase transitions \| liquid-liquid transition]] <ref>[http://dx.doi.org/10.1038/nature13405 Jeremy C. Palmer, Fausto Martelli, Yang Liu, Roberto Car, Athanassios Z. Panagiotopoulos and Pablo G. Debenedetti "Metastable liquid–liquid transition in a molecular model of water", Nature '''510''' pp. 385-388 (2014)]</ref>.
	Liu, Panagiotopoulos, and Debenedetti		Liu, Panagiotopoulos, and Debenedetti
	<ref>[http://dx.doi.org/10.1063/1.3229892 Yang Liu, Athanassios Z. Panagiotopoulos, and Pablo G. Debenedetti "Low-temperature fluid-phase behavior of ST2 water", Journal of Chemical Physics '''131''' 104508 (2009)]</ref>		<ref>[http://dx.doi.org/10.1063/1.3229892 Yang Liu, Athanassios Z. Panagiotopoulos, and Pablo G. Debenedetti "Low-temperature fluid-phase behavior of ST2 water", Journal of Chemical Physics '''131''' 104508 (2009)]</ref>
	have located the [[Critical points \|critical point]] of the ~~[[Liquid-liquid phase transitions \|~~ liquid-liquid transition]] of the ST2 model		have located the [[Critical points \|critical point]] of the liquid-liquid transition of the ST2 model
	<ref>[http://dx.doi.org/10.1063/1.4769126 Yang Liu, Jeremy C. Palmer, Athanassios Z. Panagiotopoulos, and Pablo G. Debenedetti "Liquid-liquid transition in ST2 water", Journal of Chemical Physics '''137''' 214505 (2012)]</ref>		<ref>[http://dx.doi.org/10.1063/1.4769126 Yang Liu, Jeremy C. Palmer, Athanassios Z. Panagiotopoulos, and Pablo G. Debenedetti "Liquid-liquid transition in ST2 water", Journal of Chemical Physics '''137''' 214505 (2012)]</ref>
	to be at a [[temperature]] of <math>T_c = 237 \pm 4 ~\mathrm{K}</math>, a [[density]] of <math>\rho_c = 0.99 \pm 0.02 ~\mathrm{g/cm}^3</math> and a [[pressure]] of <math>p_c = 167 \pm 24 ~\mathrm{MPa}</math>. This finding is supported in the work of Sciortino, Saika-Voivod and Poole <ref>[http://dx.doi.org/10.1039/C1CP22316J Francesco Sciortino, Ivan Saika-Voivod and Peter H. Poole "Study of the ST2 model of water close to the liquid–liquid critical point", Phys. Chem. Chem. Phys. '''13''' pp. 19759-19764 (2011)]</ref>.		to be at a [[temperature]] of <math>T_c = 237 \pm 4 ~\mathrm{K}</math>, a [[density]] of <math>\rho_c = 0.99 \pm 0.02 ~\mathrm{g/cm}^3</math> and a [[pressure]] of <math>p_c = 167 \pm 24 ~\mathrm{MPa}</math>. This finding is supported in the work of Sciortino, Saika-Voivod and Poole <ref>[http://dx.doi.org/10.1039/C1CP22316J Francesco Sciortino, Ivan Saika-Voivod and Peter H. Poole "Study of the ST2 model of water close to the liquid–liquid critical point", Phys. Chem. Chem. Phys. '''13''' pp. 19759-19764 (2011)]</ref>.

Carl McBride: /* References */ Added a recent publication

2013-04-25T12:10:28Z

References: Added a recent publication

← Older revision		Revision as of 14:10, 25 April 2013
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	*[http://dx.doi.org/10.1063/1.464103 Teresa Head-Gordon and Frank H. Stillinger "An orientational perturbation theory for pure liquid water", Journal of Chemical Physics '''98''' pp. 3313-3327 (1993)]]		*[http://dx.doi.org/10.1063/1.464103 Teresa Head-Gordon and Frank H. Stillinger "An orientational perturbation theory for pure liquid water", Journal of Chemical Physics '''98''' pp. 3313-3327 (1993)]]
	*[http://dx.doi.org/10.1103/PhysRevLett.106.115706 Megan J. Cuthbertson and Peter H. Poole "Mixturelike Behavior Near a Liquid-Liquid Phase Transition in Simulations of Supercooled Water", Physical Review Letters '''106''' 115706 (2011)]		*[http://dx.doi.org/10.1103/PhysRevLett.106.115706 Megan J. Cuthbertson and Peter H. Poole "Mixturelike Behavior Near a Liquid-Liquid Phase Transition in Simulations of Supercooled Water", Physical Review Letters '''106''' 115706 (2011)]
			*[http://dx.doi.org/10.1063/1.4775738 Peter H. Poole, Richard K. Bowles, Ivan Saika-Voivod, and Francesco Sciortino "Free energy surface of ST2 water near the liquid-liquid phase transition", Journal of Chemical Physics '''138''' 034505 (2013)]


	[[category: water]]		[[category: water]]
	[[category: models]]		[[category: models]]

Carl McBride: /* Liquid-liquid critical point */ Added a recent publication

2012-12-12T13:44:37Z

Liquid-liquid critical point: Added a recent publication

← Older revision		Revision as of 15:44, 12 December 2012
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	Liu, Panagiotopoulos, and Debenedetti		Liu, Panagiotopoulos, and Debenedetti
	<ref>[http://dx.doi.org/10.1063/1.3229892 Yang Liu, Athanassios Z. Panagiotopoulos, and Pablo G. Debenedetti "Low-temperature fluid-phase behavior of ST2 water", Journal of Chemical Physics '''131''' 104508 (2009)]</ref>		<ref>[http://dx.doi.org/10.1063/1.3229892 Yang Liu, Athanassios Z. Panagiotopoulos, and Pablo G. Debenedetti "Low-temperature fluid-phase behavior of ST2 water", Journal of Chemical Physics '''131''' 104508 (2009)]</ref>
	have located the [[Critical points \|critical point]] of the [[Liquid-liquid phase transitions \| liquid-liquid transition]] to be at		have located the [[Critical points \|critical point]] of the [[Liquid-liquid phase transitions \| liquid-liquid transition]] of the ST2 model
	a [[temperature]] of <math>T_c = 237 \pm 4 ~\mathrm{K}</math>, a [[density]] of <math>\rho_c = 0.99 \pm 0.02 ~\mathrm{g/cm}^3</math> and a [[pressure]] of <math>p_c = 167 \pm 24 ~\mathrm{MPa}</math>. This finding is supported in the work of Sciortino, Saika-Voivod and Poole <ref>[http://dx.doi.org/10.1039/C1CP22316J Francesco Sciortino, Ivan Saika-Voivod and Peter H. Poole "Study of the ST2 model of water close to the liquid–liquid critical point", Phys. Chem. Chem. Phys. '''13''' pp. 19759-19764 (2011)]</ref>.		<ref>[http://dx.doi.org/10.1063/1.4769126 Yang Liu, Jeremy C. Palmer, Athanassios Z. Panagiotopoulos, and Pablo G. Debenedetti "Liquid-liquid transition in ST2 water", Journal of Chemical Physics '''137''' 214505 (2012)]</ref>
			to be at a [[temperature]] of <math>T_c = 237 \pm 4 ~\mathrm{K}</math>, a [[density]] of <math>\rho_c = 0.99 \pm 0.02 ~\mathrm{g/cm}^3</math> and a [[pressure]] of <math>p_c = 167 \pm 24 ~\mathrm{MPa}</math>. This finding is supported in the work of Sciortino, Saika-Voivod and Poole <ref>[http://dx.doi.org/10.1039/C1CP22316J Francesco Sciortino, Ivan Saika-Voivod and Peter H. Poole "Study of the ST2 model of water close to the liquid–liquid critical point", Phys. Chem. Chem. Phys. '''13''' pp. 19759-19764 (2011)]</ref>.

	==References==		==References==

Carl McBride: /* Liquid-liquid critical point */ Added a recent publication

2011-11-02T10:54:10Z

Liquid-liquid critical point: Added a recent publication

← Older revision		Revision as of 12:54, 2 November 2011
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	<ref>[http://dx.doi.org/10.1063/1.3229892 Yang Liu, Athanassios Z. Panagiotopoulos, and Pablo G. Debenedetti "Low-temperature fluid-phase behavior of ST2 water", Journal of Chemical Physics '''131''' 104508 (2009)]</ref>		<ref>[http://dx.doi.org/10.1063/1.3229892 Yang Liu, Athanassios Z. Panagiotopoulos, and Pablo G. Debenedetti "Low-temperature fluid-phase behavior of ST2 water", Journal of Chemical Physics '''131''' 104508 (2009)]</ref>
	have located the [[Critical points \|critical point]] of the [[Liquid-liquid phase transitions \| liquid-liquid transition]] to be at		have located the [[Critical points \|critical point]] of the [[Liquid-liquid phase transitions \| liquid-liquid transition]] to be at
	a [[temperature]] of <math>T_c = 237 \pm 4 ~\mathrm{K}</math>, a [[density]] of <math>\rho_c = 0.99 \pm 0.02 ~\mathrm{g/cm}^3</math> and a [[pressure]] of <math>p_c = 167 \pm 24 ~\mathrm{MPa}</math>.		a [[temperature]] of <math>T_c = 237 \pm 4 ~\mathrm{K}</math>, a [[density]] of <math>\rho_c = 0.99 \pm 0.02 ~\mathrm{g/cm}^3</math> and a [[pressure]] of <math>p_c = 167 \pm 24 ~\mathrm{MPa}</math>. This finding is supported in the work of Sciortino, Saika-Voivod and Poole <ref>[http://dx.doi.org/10.1039/C1CP22316J Francesco Sciortino, Ivan Saika-Voivod and Peter H. Poole "Study of the ST2 model of water close to the liquid–liquid critical point", Phys. Chem. Chem. Phys. '''13''' pp. 19759-19764 (2011)]</ref>.

	==References==		==References==
	<references/>		<references/>

Carl McBride: Added a recent publication

2011-05-18T13:37:47Z

Added a recent publication

← Older revision		Revision as of 15:37, 18 May 2011
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	~~{{Stub-water}}~~
	'''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==
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	'''Related reading'''		'''Related reading'''
	*[http://dx.doi.org/10.1063/1.464103 Teresa Head-Gordon and Frank H. Stillinger "An orientational perturbation theory for pure liquid water", Journal of Chemical Physics '''98''' pp. 3313-3327 (1993)]]		*[http://dx.doi.org/10.1063/1.464103 Teresa Head-Gordon and Frank H. Stillinger "An orientational perturbation theory for pure liquid water", Journal of Chemical Physics '''98''' pp. 3313-3327 (1993)]]
			*[http://dx.doi.org/10.1103/PhysRevLett.106.115706 Megan J. Cuthbertson and Peter H. Poole "Mixturelike Behavior Near a Liquid-Liquid Phase Transition in Simulations of Supercooled Water", Physical Review Letters '''106''' 115706 (2011)]
	[[category: water]]		[[category: water]]
	[[category: models]]		[[category: models]]

Nice and Tidy: ST2 moved to ST2 model of water

2010-02-23T14:46:57Z

ST2 moved to ST2 model of water

← Older revision	Revision as of 16:46, 23 February 2010
(No difference)

Carl McBride: Added link to TMD table.

2009-09-16T16:25:22Z

Added link to TMD table.

← Older revision		Revision as of 18:25, 16 September 2009
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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

Carl McBride: Added a little more.

2009-09-16T16:20:59Z

Added a little more.

← Older revision		Revision as of 18:20, 16 September 2009
Line 1:		Line 1:
	{{Stub-water}}		{{Stub-water}}
	'''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>		'''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==
	==Liquid-liquid critical point==		==Liquid-liquid critical point==
	Liu, Panagiotopoulos, and Debenedetti		Liu, Panagiotopoulos, and Debenedetti