Kirkwood-Buff theory of solutions - Revision history

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

2018-05-03T09:54:18Z

References: Added a recent publication

← Older revision		Revision as of 11:54, 3 May 2018
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	*[http://dx.doi.org/10.1063/1.4964779 R. Cortes-Huerto, K. Kremer and R. Potestio "Kirkwood-Buff integrals in the thermodynamic limit from small-sized molecular dynamics simulations", Journal of Chemical Physics '''145''' 141103 (2016)]		*[http://dx.doi.org/10.1063/1.4964779 R. Cortes-Huerto, K. Kremer and R. Potestio "Kirkwood-Buff integrals in the thermodynamic limit from small-sized molecular dynamics simulations", Journal of Chemical Physics '''145''' 141103 (2016)]
	*[https://doi.org/10.1063/1.5011696 David M. Rogers "Extension of Kirkwood-Buff theory to the canonical ensemble", Journal of Chemical Physics '''148''' 054102 (2018)]		*[https://doi.org/10.1063/1.5011696 David M. Rogers "Extension of Kirkwood-Buff theory to the canonical ensemble", Journal of Chemical Physics '''148''' 054102 (2018)]
			*[https://doi.org/10.1080/00268976.2018.1434908 Noura Dawass, Peter Krüger, Jean-Marc Simon & Thijs J. H. Vlugt "Kirkwood–Buff integrals of finite systems: shape effects", Molecular Physics '''116''' pp. 1573-1580 (2018)]

	[[category: statistical mechanics]]		[[category: statistical mechanics]]

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

2018-02-12T16:02:22Z

References: Added a recent publication

← Older revision		Revision as of 18:02, 12 February 2018
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	*[http://dx.doi.org/10.1063/1.3398466 Elizabeth A. Ploetz, Nikolaos Bentenitis, and Paul E. Smith "Kirkwood–Buff integrals for ideal solutions", Journal of Chemical Physics '''132''' 164501 (2010)]		*[http://dx.doi.org/10.1063/1.3398466 Elizabeth A. Ploetz, Nikolaos Bentenitis, and Paul E. Smith "Kirkwood–Buff integrals for ideal solutions", Journal of Chemical Physics '''132''' 164501 (2010)]
	*[http://dx.doi.org/10.1063/1.4964779 R. Cortes-Huerto, K. Kremer and R. Potestio "Kirkwood-Buff integrals in the thermodynamic limit from small-sized molecular dynamics simulations", Journal of Chemical Physics '''145''' 141103 (2016)]		*[http://dx.doi.org/10.1063/1.4964779 R. Cortes-Huerto, K. Kremer and R. Potestio "Kirkwood-Buff integrals in the thermodynamic limit from small-sized molecular dynamics simulations", Journal of Chemical Physics '''145''' 141103 (2016)]
			*[https://doi.org/10.1063/1.5011696 David M. Rogers "Extension of Kirkwood-Buff theory to the canonical ensemble", Journal of Chemical Physics '''148''' 054102 (2018)]

	[[category: statistical mechanics]]		[[category: statistical mechanics]]

Carl McBride: Typesetting

2016-10-17T12:24:32Z

Typesetting

← Older revision		Revision as of 14:24, 17 October 2016
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	*[http://dx.doi.org/10.1063/1.434669 A. Ben-Naim "Inversion of the Kirkwood–Buff theory of solutions: Application to the water–ethanol system", Journal of Chemical Physics '''67''' pp. 4884-4890 (1977)]		*[http://dx.doi.org/10.1063/1.434669 A. Ben-Naim "Inversion of the Kirkwood–Buff theory of solutions: Application to the water–ethanol system", Journal of Chemical Physics '''67''' pp. 4884-4890 (1977)]
	*[http://dx.doi.org/10.1063/1.2938859 Arieh Ben-Naim "The Kirkwood–Buff integrals for one-component liquids" Journal of Chemical Physics '''128''' 234501 (2008)]		*[http://dx.doi.org/10.1063/1.2938859 Arieh Ben-Naim "The Kirkwood–Buff integrals for one-component liquids" Journal of Chemical Physics '''128''' 234501 (2008)]
	*[http://dx.doi.org/10.1063/1.3398466 Elizabeth A. Ploetz, Nikolaos Bentenitis, and Paul E. Smith "Kirkwood–Buff integrals for ideal solutions", Journal of Chemical Physics 132, 164501 (2010)]		*[http://dx.doi.org/10.1063/1.3398466 Elizabeth A. Ploetz, Nikolaos Bentenitis, and Paul E. Smith "Kirkwood–Buff integrals for ideal solutions", Journal of Chemical Physics '''132''' 164501 (2010)]
	*[http://dx.doi.org/10.1063/1.4964779 R. Cortes-Huerto, K. Kremer and R. Potestio "Kirkwood-Buff integrals in the thermodynamic limit from small-sized molecular dynamics simulations", Journal of Chemical Physics '''145''' 141103 (2016)]		*[http://dx.doi.org/10.1063/1.4964779 R. Cortes-Huerto, K. Kremer and R. Potestio "Kirkwood-Buff integrals in the thermodynamic limit from small-sized molecular dynamics simulations", Journal of Chemical Physics '''145''' 141103 (2016)]

	[[category: statistical mechanics]]		[[category: statistical mechanics]]

Carl McBride: Added a recent publication

2016-10-17T12:23:14Z

Added a recent publication

← Older revision		Revision as of 14:23, 17 October 2016
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	*[http://dx.doi.org/10.1063/1.2938859 Arieh Ben-Naim "The Kirkwood–Buff integrals for one-component liquids" Journal of Chemical Physics '''128''' 234501 (2008)]		*[http://dx.doi.org/10.1063/1.2938859 Arieh Ben-Naim "The Kirkwood–Buff integrals for one-component liquids" Journal of Chemical Physics '''128''' 234501 (2008)]
	*[http://dx.doi.org/10.1063/1.3398466 Elizabeth A. Ploetz, Nikolaos Bentenitis, and Paul E. Smith "Kirkwood–Buff integrals for ideal solutions", Journal of Chemical Physics 132, 164501 (2010)]		*[http://dx.doi.org/10.1063/1.3398466 Elizabeth A. Ploetz, Nikolaos Bentenitis, and Paul E. Smith "Kirkwood–Buff integrals for ideal solutions", Journal of Chemical Physics 132, 164501 (2010)]
			*[http://dx.doi.org/10.1063/1.4964779 R. Cortes-Huerto, K. Kremer and R. Potestio "Kirkwood-Buff integrals in the thermodynamic limit from small-sized molecular dynamics simulations", Journal of Chemical Physics '''145''' 141103 (2016)]

	[[category: statistical mechanics]]		[[category: statistical mechanics]]

Carl McBride: Added a recent publication

2010-04-23T09:33:42Z

Added a recent publication

← Older revision		Revision as of 11:33, 23 April 2010
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	{{Stub-general}}		{{Stub-general}}
	~~====~~Kirkwood-Buff integrals~~====~~		'''Kirkwood-Buff integrals''' <ref>[http://dx.doi.org/10.1063/1.1748352 John G. Kirkwood and Frank P. Buff "The Statistical Mechanical Theory of Solutions. I", Journal of Chemical Physics '''19''' pp. 774-777 (1951)]</ref>
	:<math>G_{\alpha \beta} = \int_0^\infty \left[{\mathrm g}_{\alpha \beta}^{(2)}({\mathbf r})-1\right] 4\pi r^2 ~d{\mathbf r}</math>		:<math>G_{\alpha \beta} = \int_0^\infty \left[{\mathrm g}_{\alpha \beta}^{(2)}({\mathbf r})-1\right] 4\pi r^2 ~d{\mathbf r}</math>
	where <math>{\mathrm g}_{\alpha \beta}({\mathbf r})</math> is the [[pair distribution function]].		where <math>{\mathrm g}_{\alpha \beta}({\mathbf r})</math> is the [[pair distribution function]].
	==References==		==References==
	~~#[http:~~/~~/dx.doi.org/10.1063/1.1748352 John G. Kirkwood and Frank P. Buff "The Statistical Mechanical Theory of Solutions. I", Journal of Chemical Physics~~ '''19''' ~~pp. 774-777 (1951)]~~		<references/>
	#[http://dx.doi.org/10.1063/1.434669 A. Ben-Naim "Inversion of the Kirkwood–Buff theory of solutions: Application to the water–ethanol system", Journal of Chemical Physics '''67''' pp. 4884-4890 (1977)]		'''Related reading'''
	#[http://dx.doi.org/10.1063/1.2938859 Arieh Ben-Naim "The Kirkwood–Buff integrals for one-component liquids" Journal of Chemical Physics '''128''' 234501 (2008)]		*[http://dx.doi.org/10.1063/1.434669 A. Ben-Naim "Inversion of the Kirkwood–Buff theory of solutions: Application to the water–ethanol system", Journal of Chemical Physics '''67''' pp. 4884-4890 (1977)]
			*[http://dx.doi.org/10.1063/1.2938859 Arieh Ben-Naim "The Kirkwood–Buff integrals for one-component liquids" Journal of Chemical Physics '''128''' 234501 (2008)]
			*[http://dx.doi.org/10.1063/1.3398466 Elizabeth A. Ploetz, Nikolaos Bentenitis, and Paul E. Smith "Kirkwood–Buff integrals for ideal solutions", Journal of Chemical Physics 132, 164501 (2010)]

	[[category: statistical mechanics]]		[[category: statistical mechanics]]

Carl McBride: /* References */ Added a reference

2008-06-24T09:52:52Z

References: Added a reference

← Older revision		Revision as of 11:52, 24 June 2008
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	#[http://dx.doi.org/10.1063/1.1748352 John G. Kirkwood and Frank P. Buff "The Statistical Mechanical Theory of Solutions. I", Journal of Chemical Physics '''19''' pp. 774-777 (1951)]		#[http://dx.doi.org/10.1063/1.1748352 John G. Kirkwood and Frank P. Buff "The Statistical Mechanical Theory of Solutions. I", Journal of Chemical Physics '''19''' pp. 774-777 (1951)]
	#[http://dx.doi.org/10.1063/1.434669 A. Ben-Naim "Inversion of the Kirkwood–Buff theory of solutions: Application to the water–ethanol system", Journal of Chemical Physics '''67''' pp. 4884-4890 (1977)]		#[http://dx.doi.org/10.1063/1.434669 A. Ben-Naim "Inversion of the Kirkwood–Buff theory of solutions: Application to the water–ethanol system", Journal of Chemical Physics '''67''' pp. 4884-4890 (1977)]
			#[http://dx.doi.org/10.1063/1.2938859 Arieh Ben-Naim "The Kirkwood–Buff integrals for one-component liquids" Journal of Chemical Physics '''128''' 234501 (2008)]
	[[category: statistical mechanics]]		[[category: statistical mechanics]]

Carl McBride: New page: {{Stub-general}} ====Kirkwood-Buff integrals==== : $G_{\alpha \beta} = \int_0^\infty \left[{\mathrm g}_{\alpha \beta}^{(2)}({\mathbf r})-1\right] 4\pi r^2 ~d{\mathbf r}$ where
2007-11-19T13:09:31Z

New page: {{Stub-general}} ====Kirkwood-Buff integrals==== :<math>G_{\alpha \beta} = \int_0^\infty \left[{\mathrm g}_{\alpha \beta}^{(2)}({\mathbf r})-1\right] 4\pi r^2 ~d{\mathbf r}</math> where <m...

New page
{{Stub-general}}
====Kirkwood-Buff integrals====
:<math>G_{\alpha \beta} = \int_0^\infty \left[{\mathrm g}_{\alpha \beta}^{(2)}({\mathbf r})-1\right] 4\pi r^2 ~d{\mathbf r}</math>
where <math>{\mathrm g}_{\alpha \beta}({\mathbf r})</math> is the [[pair distribution function]].
==References==
#[http://dx.doi.org/10.1063/1.1748352 John G. Kirkwood and Frank P. Buff "The Statistical Mechanical Theory of Solutions. I", Journal of Chemical Physics '''19''' pp. 774-777 (1951)]
#[http://dx.doi.org/10.1063/1.434669 A. Ben-Naim "Inversion of the Kirkwood–Buff theory of solutions: Application to the water–ethanol system", Journal of Chemical Physics '''67''' pp. 4884-4890 (1977)]
[[category: statistical mechanics]]