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Energetics and reactivity of small beryllium deuterides

Enthalpies and free energies of reaction for small neutral and charged beryllium deuterides BeD, BeD(2), and BeD(3) that have been calculated are reported for a temperature range of 0 K to 1000 K. We discuss probable dissociation channels and possible ways of producing BeD by localizing the relevant...

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Publicat a:J Mol Model
Autors principals: Sukuba, Ivan, Kaiser, Alexander, Huber, Stefan E., Urban, Jan, Probst, Michael
Format: Artigo
Idioma:Inglês
Publicat: Springer Berlin Heidelberg 2017
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Accés en línia:https://ncbi.nlm.nih.gov/pmc/articles/PMC5487901/
https://ncbi.nlm.nih.gov/pubmed/28623599
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1007/s00894-017-3362-4
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