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exercises:2017_ethz_mmm:lennard_jones_cluster_neb [2017/02/24 09:42] – dpasseroneexercises:2017_ethz_mmm:lennard_jones_cluster_neb [2017/02/24 09:43] – dpasserone
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 ====== 38 atom Lennard-Jones cluster: nudged elastic band ====== ====== 38 atom Lennard-Jones cluster: nudged elastic band ======
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 +{{:exercises:2017_ethz_mmm:pathneb.png?800|}}
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 In this second exercise we will find a transition path between a icosahedral-like minimum and a fcc-like minimum. In this second exercise we will find a transition path between a icosahedral-like minimum and a fcc-like minimum.
  
exercises/2017_ethz_mmm/lennard_jones_cluster_neb.txt · Last modified: 2020/08/21 10:15 by 127.0.0.1