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The perturbation calculation of van der Waals potentials

โœ Scribed by K. T. Tang; J. Peter Toennies; C. L. Yiu


Publisher
Springer
Year
1994
Tongue
English
Weight
688 KB
Volume
88
Category
Article
ISSN
1432-2234

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๐Ÿ“œ SIMILAR VOLUMES


Fast Ewald sums for general van der Waal
โœ Chen, Zhuo-Min; ๏ฟฝa?in, Tahir; Goddard, William A. ๐Ÿ“‚ Article ๐Ÿ“… 1997 ๐Ÿ› John Wiley and Sons ๐ŸŒ English โš– 176 KB

This work considers ways to increase calculation speed for Ewald crystal summations in cases where standard combination rules do not apply. This also increases speed of free-energy perturbation theory calculations.