Publications

L.M. McRae, R.C. Radomsky, J.T. Pawlik, D.L. Druffel, J.D. Sundberg, M.G. Lanetti, C.L. Donley, K.L. White, S.C. Warren. Sc2C, a 2D semiconducting electride. J. Am. Chem. Soc., (2022), 24, 10862–10869.

• batteries
• synthesis
• electrides
• DFT

J.D. Sundberg, D.L. Druffel, L.M. McRae, M.G. Lanetti, J.T. Pawlik, S.C. Warren. High-throughput discovery of fluoride-ion conductors via a decoupled, dynamic, and iterative (DDI) framework. npj Computational Materials, (2022), 8, 106.

• batteries
• computation
• high-throughput

D. Druffel, J. Pawlik, J. Sundberg, L. McRae, M. Lanetti, S. Warren. First-Principles Prediction of Electrochemical Electron–Anion Exchange: Ion Insertion without Redox. J. Phys. Chem. Lett., (2020), 11, 9210-9214.

• batteries
• electrides
• DFT