Published in
Royal Society of Chemistry, Physical Chemistry Chemical Physics, 7(22), p. 4177-4192, 2020
DOI: 10.1039/c9cp05719f
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Interfacial structure in the liquid–liquid extraction of rare earth elements by phosphoric acid ligands: a molecular dynamics study
Journal article published in 2020 by
Balarama Sridhar Dwadasi 
,
Sriram Goverapet Srinivasan ,
Beena Rai
,
Sriram Goverapet Srinivasan ,
Beena Rai
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Abstract
MD simulations reveal the chemical and physical heterogeneity at the liquid–liquid interface, nature of complexes formed by phosphoric acid ligands with lanthanides, and the sequence of events in the extraction of these ions.