most citedPrediction of Li intercalation voltages in rechargeable battery cathode materials: effects of exchange-correlation functional, van der Waals interactions, and Hubbard

23 citations · 23 across the 1 of their papers we have counts for

collaborators

1 paper

cond-mat.mtrl-sci2020★ 23 cited

Prediction of Li intercalation voltages in rechargeable battery cathode materials: effects of exchange-correlation functional, van der Waals interactions, and Hubbard

Eric B. Isaacs, Shane Patel, Chris Wolverton

Quantitative predictions of the Li intercalation voltage and of the electronic properties of rechargeable battery cathode materials are a substantial challenge for first-principles…