Breaking points in centralizer lattices
Sign Up to like & getrecommendations! Published in 2018 at "Comptes Rendus Mathematique"
DOI: 10.1016/j.crma.2018.06.006
Abstract: In this note, we prove that the centralizer lattice ${\mathfrak C}(G)$ of a group $G$ cannot be written as a union of two proper intervals. In particular, it follows that ${\mathfrak C}(G)$ has no breaking… read more here.
Keywords: centralizer lattices; centralizer; points centralizer; breaking points ... See more keywords
Barnes Update Applied in the Gauss-Newton Method: An Improved Algorithm to Locate Bond Breaking Points.
Sign Up to like & getrecommendations! Published in 2021 at "Journal of chemical theory and computation"
DOI: 10.1021/acs.jctc.0c00910
Abstract: A mechanochemical reaction is a reaction induced by mechanical energy. A general accepted model for this type of reaction consists of a first-order perturbation on the associated potential energy surface (PES) of the unperturbed molecular… read more here.
Keywords: bond breaking; method; algorithm locate; newton method ... See more keywords