Publications

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Journal Articles:

Earlier:

  • V Erastova, J Rodríguez-Otero, EM Cabaleiro-Lago & A Peña-Gallego. “A computational study of the mechanism of the unimolecular elimination of α,β-unsaturated aldehydes in the gas phase”. Journal of Molecular Modeling (2011)


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co-first and corresponding author

Thesis:

V Erastova,Molecular simulation studies of diesel and diesel additives, 2013 (under 5 year embargo)

Master’s Dissertation:

V Erastova, “An ab initio and DFT study of the mechanism of unimolecular elimination of α,β-unsaturated aldehydes”, 2008

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