Models - Revision history

Carl McBride: Removed top 5 section

2011-06-27T09:50:31Z

Removed top 5 section

← Older revision		Revision as of 11:50, 27 June 2011
Line 5:		Line 5:
	'''Force fields''' consist of (hopefully) transferable parameters for molecular sub-units. They are designed to be applicable to a variety of molecular systems, over a range of thermodynamic conditions.		'''Force fields''' consist of (hopefully) transferable parameters for molecular sub-units. They are designed to be applicable to a variety of molecular systems, over a range of thermodynamic conditions.
	*[[Force fields \| List of force-fields]]		*[[Force fields \| List of force-fields]]
	~~==Top-5 most viewed models==~~
	~~{{popular models}}~~
	==Interesting reading==		==Interesting reading==
	*[http://dx.doi.org/10.1126/science.157.3787.375 B. Widom "Intermolecular Forces and the Nature of the Liquid State: Liquids reflect in their bulk properties the attractions and repulsions of their constituent molecules", Science '''157''' pp. 375-382 (1967)]		*[http://dx.doi.org/10.1126/science.157.3787.375 B. Widom "Intermolecular Forces and the Nature of the Liquid State: Liquids reflect in their bulk properties the attractions and repulsions of their constituent molecules", Science '''157''' pp. 375-382 (1967)]
	[[category:Computer simulation techniques]]		[[category:Computer simulation techniques]]

Carl McBride: A little more detail.

2008-09-15T11:00:42Z

A little more detail.

← Older revision		Revision as of 13:00, 15 September 2008
Line 1:		Line 1:
	'''Idealised models''' usually consist of a simple [[Intermolecular pair potential\|intermolecular pair potential]], whose purpose is often to study underlying physical phenomena, such as generalised [[phase diagrams]] and the study of [[phase transitions]].		'''Idealised models''' usually consist of a simple [[Intermolecular pair potential\|intermolecular pair potential]], whose purpose is often to study underlying physical phenomena, such as generalised [[phase diagrams]] and the study of [[phase transitions]]. It is entirely possible that a number of the models bear little or no resemblance to real molecular fluids.
	*[[Idealised models\| List of idealised models]]		*[[Idealised models\| List of idealised models]]
	'''Realistic models''' are usually variants of idealised models, parametrised to study a specific atomic or molecular system with a certain degree of realism.		'''Realistic models''' are usually variants of idealised models, parametrised to study a specific atomic or molecular system with a certain degree of realism. These models are usually designed to reproduce a subset of experimental physical properties, thus a certain model may be more suitable to a particular study, whist being wholly inadequate in the study of a distinct question.
	*[[Realistic models \| List of realistic models]]		*[[Realistic models \| List of realistic models]]
	'''Force fields''' consist of (hopefully) transferable parameters for molecular sub-units. They are designed to be applicable to a variety of molecular systems, over a range of thermodynamic conditions.		'''Force fields''' consist of (hopefully) transferable parameters for molecular sub-units. They are designed to be applicable to a variety of molecular systems, over a range of thermodynamic conditions.

Carl McBride: Slight edit.

2008-08-04T12:00:38Z

Slight edit.

← Older revision		Revision as of 14:00, 4 August 2008
Line 1:		Line 1:
	Idealised models usually consist of a simple [[Intermolecular pair potential\|intermolecular pair potential]], whose purpose is often to study underlying physical phenomena.		'''Idealised models''' usually consist of a simple [[Intermolecular pair potential\|intermolecular pair potential]], whose purpose is often to study underlying physical phenomena, such as generalised [[phase diagrams]] and the study of [[phase transitions]].
	*[[Idealised models\| List of idealised models]]		*[[Idealised models\| List of idealised models]]
	Realistic models are usually ~~designed~~ to study a specific atomic or molecular system with a certain degree of realism.		'''Realistic models''' are usually variants of idealised models, parametrised to study a specific atomic or molecular system with a certain degree of realism.
	*[[Realistic models \| List of realistic models]]		*[[Realistic models \| List of realistic models]]
	Force fields consist of, hopefully transferable, parameters for molecular sub-units. They are designed to be applicable to a variety of molecular systems, over a range of conditions.		'''Force fields''' consist of (hopefully) transferable parameters for molecular sub-units. They are designed to be applicable to a variety of molecular systems, over a range of thermodynamic conditions.
	*[[Force fields \| List of force-fields]]		*[[Force fields \| List of force-fields]]
	==Top-5 most viewed models==		==Top-5 most viewed models==

Carl McBride at 09:44, 4 July 2008

2008-07-04T09:44:01Z

← Older revision		Revision as of 11:44, 4 July 2008
Line 5:		Line 5:
	Force fields consist of, hopefully transferable, parameters for molecular sub-units. They are designed to be applicable to a variety of molecular systems, over a range of conditions.		Force fields consist of, hopefully transferable, parameters for molecular sub-units. They are designed to be applicable to a variety of molecular systems, over a range of conditions.
	*[[Force fields \| List of force-fields]]		*[[Force fields \| List of force-fields]]
			==Top-5 most viewed models==
			{{popular models}}
	==Interesting reading==		==Interesting reading==
	*[http://dx.doi.org/10.1126/science.157.3787.375 B. Widom "Intermolecular Forces and the Nature of the Liquid State: Liquids reflect in their bulk properties the attractions and repulsions of their constituent molecules", Science '''157''' pp. 375-382 (1967)]		*[http://dx.doi.org/10.1126/science.157.3787.375 B. Widom "Intermolecular Forces and the Nature of the Liquid State: Liquids reflect in their bulk properties the attractions and repulsions of their constituent molecules", Science '''157''' pp. 375-382 (1967)]
	[[category:Computer simulation techniques]]		[[category:Computer simulation techniques]]

Carl McBride: Removed models category

2008-07-04T09:42:52Z

Removed models category

← Older revision		Revision as of 11:42, 4 July 2008
Line 7:		Line 7:
	==Interesting reading==		==Interesting reading==
	*[http://dx.doi.org/10.1126/science.157.3787.375 B. Widom "Intermolecular Forces and the Nature of the Liquid State: Liquids reflect in their bulk properties the attractions and repulsions of their constituent molecules", Science '''157''' pp. 375-382 (1967)]		*[http://dx.doi.org/10.1126/science.157.3787.375 B. Widom "Intermolecular Forces and the Nature of the Liquid State: Liquids reflect in their bulk properties the attractions and repulsions of their constituent molecules", Science '''157''' pp. 375-382 (1967)]
	~~[[category:models]]~~
	[[category:Computer simulation techniques]]		[[category:Computer simulation techniques]]

Carl McBride: Slight re-arrangement of page.

2008-03-10T15:20:50Z

Slight re-arrangement of page.

← Older revision		Revision as of 17:20, 10 March 2008
Line 1:		Line 1:
	*[[Idealised models]]		Idealised models usually consist of a simple [[Intermolecular pair potential\|intermolecular pair potential]], whose purpose is often to study underlying physical phenomena.
	:Idealised models usually consist of a simple [[Intermolecular pair potential\|intermolecular pair potential]], whose purpose is often to study underlying physical phenomena.		*[[Idealised models\| List of idealised models]]
	*[[~~Realistic~~ models]]		Realistic models are usually designed to study a specific atomic or molecular system with a certain degree of realism.
	:Realistic models are usually designed to study a specific atomic or molecular system with a certain degree of realism.		*[[Realistic models \| List of realistic models]]
	*[[~~Force fields~~]]		Force fields consist of, hopefully transferable, parameters for molecular sub-units. They are designed to be applicable to a variety of molecular systems, over a range of conditions.
	:Force fields consist of, hopefully transferable, parameters for molecular sub-units. They are designed to be applicable to a variety of molecular systems, over a range of conditions.		*[[Force fields \| List of force-fields]]
	==Interesting reading==		==Interesting reading==
	*[http://dx.doi.org/10.1126/science.157.3787.375 B. Widom "Intermolecular Forces and the Nature of the Liquid State: Liquids reflect in their bulk properties the attractions and repulsions of their constituent molecules", Science '''157''' pp. 375-382 (1967)]		*[http://dx.doi.org/10.1126/science.157.3787.375 B. Widom "Intermolecular Forces and the Nature of the Liquid State: Liquids reflect in their bulk properties the attractions and repulsions of their constituent molecules", Science '''157''' pp. 375-382 (1967)]
	[[category:models]]		[[category:models]]
	[[category:Computer simulation techniques]]		[[category:Computer simulation techniques]]

Carl McBride: Added breif descriptions.

2008-01-23T10:08:02Z

Added breif descriptions.

← Older revision		Revision as of 12:08, 23 January 2008
Line 1:		Line 1:
	*[[Idealised models]]		*[[Idealised models]]
			:Idealised models usually consist of a simple [[Intermolecular pair potential\|intermolecular pair potential]], whose purpose is often to study underlying physical phenomena.
	*[[Realistic models]]		*[[Realistic models]]
			:Realistic models are usually designed to study a specific atomic or molecular system with a certain degree of realism.
	*[[Force fields]]		*[[Force fields]]
			:Force fields consist of, hopefully transferable, parameters for molecular sub-units. They are designed to be applicable to a variety of molecular systems, over a range of conditions.
	==Interesting reading==		==Interesting reading==
	*[http://dx.doi.org/10.1126/science.157.3787.375 B. Widom "Intermolecular Forces and the Nature of the Liquid State: Liquids reflect in their bulk properties the attractions and repulsions of their constituent molecules", Science '''157''' pp. 375-382 (1967)]		*[http://dx.doi.org/10.1126/science.157.3787.375 B. Widom "Intermolecular Forces and the Nature of the Liquid State: Liquids reflect in their bulk properties the attractions and repulsions of their constituent molecules", Science '''157''' pp. 375-382 (1967)]
	[[category:models]]		[[category:models]]
	[[category:Computer simulation techniques]]		[[category:Computer simulation techniques]]

Carl McBride at 13:19, 6 September 2007

2007-09-06T13:19:52Z

← Older revision		Revision as of 15:19, 6 September 2007
Line 2:		Line 2:
	*[[Realistic models]]		*[[Realistic models]]
	*[[Force fields]]		*[[Force fields]]
			==Interesting reading==
			*[http://dx.doi.org/10.1126/science.157.3787.375 B. Widom "Intermolecular Forces and the Nature of the Liquid State: Liquids reflect in their bulk properties the attractions and repulsions of their constituent molecules", Science '''157''' pp. 375-382 (1967)]
	[[category:models]]		[[category:models]]
	[[category:Computer simulation techniques]]		[[category:Computer simulation techniques]]

Noe at 14:02, 6 June 2007

2007-06-06T14:02:12Z

← Older revision		Revision as of 16:02, 6 June 2007
Line 1:		Line 1:
	*[[Idealised models]]		*[[Idealised models]]
	*[[~~Ralistic~~ models]]		*[[Realistic models]]
	*[[Force fields]]		*[[Force fields]]
	[[category:models]]		[[category:models]]
	[[category:Computer simulation techniques]]		[[category:Computer simulation techniques]]

Carl McBride: Replacing page with 'Idealised models Ralistic models *Force fields category:models category:Computer simulation techniques'

2007-06-04T09:40:51Z

Replacing page with '*Idealised models *Ralistic models *Force fields category:models category:Computer simulation techniques'

@@ Line 2: / Line 2: @@
 *[[Ralistic models]]
 *[[Force fields]]
 [[category:models]]
 [[category:Computer simulation techniques]]