Testing Different Nonsmooth Formulations of the Lennard–Jones Potential in Atomic Clustering Problems
Author:
Funder
Luonnontieteiden ja Tekniikan Tutkimuksen Toimikunta
Publisher
Springer Science and Business Media LLC
Subject
Applied Mathematics,Management Science and Operations Research,Control and Optimization
Link
http://link.springer.com/content/pdf/10.1007/s10957-016-0955-5.pdf
Reference24 articles.
1. Kostrowicki, J., Piela, L., Cherayil, B.J., Scheraga, H.A.: Performance of the diffusion equation method in searches for optimum structures of clusters of Lennard–Jones atoms. J. Phys. Chem. 95, 4113–4119 (1991)
2. Wales, D.J.: Rearrangements of 55-atom Lennard–Jones and (C60)55 clusters. J. Chem. Phys. 101, 3750–3762 (1994)
3. Yeak, S.H., Ng, T.Y., Liew, K.M.: Multiscale modeling of carbon nanotubes under axial tension and compression. Phys. Rev. B 72(16), 165401 (2005). doi: 10.1103/PhysRevB.72.165401
4. Lampariello, F., Liuzzi, G.: Global optimization of protein-peptide docking by a filling function method. J. Optim. Theory Appl. 164, 1090–1108 (2015)
5. Leach, A.R.: Molecular Modelling: Principles and Applications, 2nd edn. Pearson Education Limited, Harlow (2001)
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