Publication: Global minimization of lennard-jones potential
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Date
2019-05
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Don Mariano Marcos Memorial State University - South La Union Campus
Abstract
This study focused on finding a method that obtains the global minimum of the
Lennard-.lones potential junction. Existing numerical methods are applied to the jimction
and compared in terms of its convergence. Also, a new global minimization approach
specifically for the LJ potential function was proposed and was implemented through
programming in MA TUB. Six existing methods u'ere discussed and applied to the
function to come up with observations that lead to theformulation of a new minimization
approach specific for the LJ potential function. An algorithm was created and
implemented in MA TLAB to aide in the computations.
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Citation
Soquila, J. M., Buentipo, J. J. C., Ofilada, J. E., & QuiƱones, C. C. (2019) Global minimization of lennard-jones potential [Unpublished Undergradaute thesis]. Don Mariano Marcos Memorial State University - South La Union Campus, Agoo, La Union.