Water clusters: Difference between revisions

From SklogWiki
Jump to navigation Jump to search
m (added bibliography)
m (→‎Global minima structures: Added an internal link for the q-TIP4P/F model)
 
(4 intermediate revisions by the same user not shown)
Line 1: Line 1:
====Global minima structures====  
====Global minima structures====  
Note: these links lead to pages that contain several Java applets that may take a while to load.
The following are pages of results for a number of [[water models]]. '''Note:''' these links lead to pages that contain several Java applets that may take a while to load.
*[[Water clusters: TIP3P model‎ | TIP3P model]]
*[[Water clusters: TIP3P model‎ | TIP3P model]]
*[[Water clusters: TIP4P model‎ | TIP4P model]]
*[[Water clusters: TIP4P model‎ | TIP4P model]]
*[[Water clusters: TIP4P/2005 model‎ | TIP4P/2005 model]]
*[[Water clusters: TIP4P/2005 model‎ | TIP4P/2005 model]]
*[[Water clusters: TIP4PQ/2005 model‎ | TIP4PQ/2005 model]]
*[[Water clusters: TIP4PQ/2005 model‎ | TIP4PQ/2005 model]]
*[[Water clusters: q-TIP4P/F model | q-TIP4P/F model  ]]
*[[Water clusters: TIP5P model‎ | TIP5P model]]
*[[Water clusters: TIP5P model‎ | TIP5P model]]
==Related reading==
==Related reading==
*[http://www3.interscience.wiley.com/journal/48543/abstract J. A. Niesse and Howard R. Mayne "Global optimization of atomic and molecular clusters using the space-fixed modified genetic algorithm method", Journal of Computational Chemistry '''18''' pp. 1233-1244 (1997)]
*[http://www3.interscience.wiley.com/journal/48543/abstract J. A. Niesse and Howard R. Mayne "Global optimization of atomic and molecular clusters using the space-fixed modified genetic algorithm method", Journal of Computational Chemistry '''18''' pp. 1233-1244 (1997)]
*[http://dx.doi.org/10.1016/S0009-2614(98)00065-7  David J. Wales and Matthew P. Hodges "Global minima of water clusters (H2O)n, n≤21, described by an empirical potential", Chemical Physics Letters '''286''' pp. 65-72 (1998)]
*[http://dx.doi.org/10.1016/S0009-2614(98)00065-7  David J. Wales and Matthew P. Hodges "Global minima of water clusters (H2O)n, n≤21, described by an empirical potential", Chemical Physics Letters '''286''' pp. 65-72 (1998)]
*[http://dx.doi.org/10.1021/jp027783q H. Kabrede and R. Hentschke "Global Minima of Water Clusters (H2O)N, N ≤ 25, Described by Three Empirical Potentials", Journal of Physical Chemistry B '''107''' pp. 3914-3920 (2003)]
*[http://dx.doi.org/10.1021/jp027783q H. Kabrede and R. Hentschke "Global Minima of Water Clusters (H2O)N, N ≤ 25, Described by Three Empirical Potentials", Journal of Physical Chemistry B '''107''' pp. 3914-3920 (2003)]
* [http://dx.doi.org/10.1016/j.cplett.2005.09.019 T. James, D.J. Wales and J. Hernández-Rojas " Global minima for water clusters (H2O)n, n < 21, described by a five-site empirical potential", Chemical Physics Letter, 415, 302 (2005)]
*[http://dx.doi.org/10.1016/j.cplett.2005.09.019 T. James, D. J. Wales and J. Hernández-Rojas " Global minima for water clusters (H2O)n, n &#8804; 21, described by a five-site empirical potential", Chemical Physics Letters '''415''' pp. 302-307 (2005)]
*[http://dx.doi.org/10.1021/jp910770y Briesta S. González, Eva G. Noya, Carlos Vega and Luis M. Sesé "Nuclear Quantum Effects in Water Clusters: The Role of the Molecular Flexibility", Journal of Physical Chemistry B (Article ASAP) (2010)]
 
==External links==
==External links==
*[http://www-wales.ch.cam.ac.uk/CCD.html The Cambridge Cluster Database]
*[http://www-wales.ch.cam.ac.uk/CCD.html The Cambridge Cluster Database]
[[category: water]]
[[category: water]]

Latest revision as of 12:24, 5 February 2010