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Structure of ethylammonium hydrogen sulfate protic ionic liquid through DFT calculations and MD simulations: the role of hydrogen bonds.

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Bibliographic Details
Title: Structure of ethylammonium hydrogen sulfate protic ionic liquid through DFT calculations and MD simulations: the role of hydrogen bonds.
Authors: Fedorova, Irina V.1 (AUTHOR) fiv@isc-ras.ru, Krestyaninov, Mikhail A.1 (AUTHOR), Safonova, Lyubov P.1 (AUTHOR)
Source: Structural Chemistry. Jun2023, Vol. 34 Issue 3, p879-890. 12p.
Database: Academic Search Ultimate
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ISSN:10400400
DOI:10.1007/s11224-022-02042-7