Prediction of dispersion forces: is there a problem?
Author(s)
Dobson, JF
McLennan, K
Rubio, A
Wang, J
Gould, T
Le, HM
Dinte, BP
Year published
2001
Metadata
Show full item recordAbstract
We discuss the ability of a number of standard and non-standard computational techniques to reproduce dispersion forces, using examples from the literature as well as some new examples. We conclude that there are still some cases where standard methods are not so far successful. There are some promising directions under study, however.We discuss the ability of a number of standard and non-standard computational techniques to reproduce dispersion forces, using examples from the literature as well as some new examples. We conclude that there are still some cases where standard methods are not so far successful. There are some promising directions under study, however.
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Journal Title
Australian Journal of Chemistry
Volume
54
Subject
Chemical sciences
Engineering