ListarCentro de investigación de Nanotecnología Aplicada (CNAP) por tema "Chemistry, Physical; Materials Science, Multidisciplinary"
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Molecular simulations of carbon allotropes in processes with creation and destruction of chemical bonds
(PERGAMON-ELSEVIER SCIENCE LTD, 2019)The development of sophisticated interatomic potentials for classical molecular dynamics and Monte Carlo simulations has several advantages, but also some drawbacks. One of them is the increase in their complexity, which ...