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Empathes: a general code for nudged elastic band transition states search - MaRDI portal

Empathes: a general code for nudged elastic band transition states search (Q6156990)

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scientific article; zbMATH DE number 7697531
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English
Empathes: a general code for nudged elastic band transition states search
scientific article; zbMATH DE number 7697531

    Statements

    title
    Empathes: a general code for nudged elastic band transition states search (English)
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    author
    M. Bertini
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    Francesco Ferrante
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    Dario Duca
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    publication date
    19 June 2023
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    zbMATH Keywords
    NEB
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    Siesta
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    chemical reactions
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    cites work
    Q5491447
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    Identifiers

    zbMATH DE Number
    7697531
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    OpenAlex ID
    W3213338194
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