Simple energy minimization for huge Lennard-Jones clusters by dramatic parameter reduction

Y. Deng; C. Rivera

doi:10.1016/S0893-9659(98)00183-9

Simple energy minimization for huge Lennard-Jones clusters by dramatic parameter reduction

Y. Deng
, C. Rivera

Applied Mathematics and Statistics

Stony Brook University

Research output: Contribution to journal › Article › peer-review

1 Scopus citations

Abstract

We have designed several schemes to reduce the number of parameters in the problem of minimizing the total energy of Lennard-Jones clusters. We will discuss our schemes development in three dimensions. The value of our work lies in the simplicity with which it provides a new approach to problems involving huge Lennard-Jones clusters.

Original language	English
Pages (from-to)	119-124
Number of pages	6
Journal	Applied Mathematics Letters
Volume	12
Issue number	3
DOIs	https://doi.org/10.1016/S0893-9659(98)00183-9
State	Published - May 1999

Keywords

Asymptotic values
Lennard-Jones clusters
Optimization

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10.1016/S0893-9659(98)00183-9

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title = "Simple energy minimization for huge Lennard-Jones clusters by dramatic parameter reduction",

abstract = "We have designed several schemes to reduce the number of parameters in the problem of minimizing the total energy of Lennard-Jones clusters. We will discuss our schemes development in three dimensions. The value of our work lies in the simplicity with which it provides a new approach to problems involving huge Lennard-Jones clusters.",

keywords = "Asymptotic values, Lennard-Jones clusters, Optimization",

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AU - Rivera, C.

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AB - We have designed several schemes to reduce the number of parameters in the problem of minimizing the total energy of Lennard-Jones clusters. We will discuss our schemes development in three dimensions. The value of our work lies in the simplicity with which it provides a new approach to problems involving huge Lennard-Jones clusters.

KW - Asymptotic values

KW - Lennard-Jones clusters

KW - Optimization

UR - https://www.scopus.com/pages/publications/0039136249

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DO - 10.1016/S0893-9659(98)00183-9

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JO - Applied Mathematics Letters

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IS - 3

ER -

Simple energy minimization for huge Lennard-Jones clusters by dramatic parameter reduction

Abstract

Keywords

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