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|Title:||The Relationship between Lennard-Jones (12-6) and Morse Potential Functions|
Van der Waals
|Source:||Lim, T.-C. (2003-11). The Relationship between Lennard-Jones (12-6) and Morse Potential Functions. Zeitschrift fur Naturforschung - Section A Journal of Physical Sciences 58 (11) : 615-617. ScholarBank@NUS Repository.|
|Abstract:||The most commonly used potentials for van der Waals interactions are the Exponential-6 and the Lennard-Jones (12-6) potential. In this paper a correlation between them is described. The Morse function, which is normally applied for quantifying 2-body interactions, has been adopted in one software. This paper deals with the validity of the Morse function for non-bonded interactions by means of obtaining a relationship between the Morse and the Lennard-Jones (12-6) potential functions. An approximate and an exact mathematical relationship is demonstrated to exist between these two potentials.|
|Source Title:||Zeitschrift fur Naturforschung - Section A Journal of Physical Sciences|
|Appears in Collections:||Staff Publications|
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