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Double Proton Transfer in the Dimer of Formic Acid: An Efficient Quantum Mechanical Scheme

Double proton transfer plays an important role in biology and chemistry, such as with DNA base pairs, proteins and molecular clusters, and direct information about these processes can be obtained from tunneling splittings. Carboxylic acid dimers are prototypes for multiple proton transfer, of which...

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Detalhes bibliográficos
Publicado no:Front Chem
Main Authors: Liu, Hao, Cao, Jianwei, Bian, Wensheng
Formato: Artigo
Idioma:Inglês
Publicado em: Frontiers Media S.A. 2019
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC6842929/
https://ncbi.nlm.nih.gov/pubmed/31750286
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3389/fchem.2019.00676
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