Ensemble-averaged QM/MM kinetic isotope effects for the S_N2 reaction of cyanide anions with chloroethane in DMSO solution

J.J. Ruiz Pernía
, Ian H Williams

Department of Chemistry

Research output: Contribution to journal › Article › peer-review

14 Citations (SciVal)

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High Performance Computing (HPC) Facility
Chapman, S. (Manager)
University of Bath
Facility/equipment: Facility