@article{26820,
  author = {Saul H Lapidus and Nav Nidhi Rajput and Xiaohui Qu and Karena W Chapman and Kristin A Persson and Peter J Chupas},
  title = {Solvation structure and energetics of electrolytes for multivalent energy storage},
  abstract = {<p>By analysing X-ray pair distribution function data using a multivariate statistical approach, we isolate the cation solvation structure for monovalent (Li+ /Na+ /K+ ) and multivalent (Mg2+/Ca2+/Zn2+) electrolytes based on TFSI salts in diglyme. Parallel molecular dynamics simulations provide enhanced structural details. The data suggest that contact ion-pairs are a common feature in multivalent electrolytes.</p>},
  year = {2014},
  journal = {Physical Chemistry Chemical Physics},
  month = {09/2014},
  doi = {10.1039/C4CP03015J},
  language = {eng},
}