Modeling the partial atomic charges in inorganometallic molecules and solids and charge redistribution in lithium-ion cathodes

Bo Wang, Shaohong L. Li, Donald G. Truhlar

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

79 Scopus citations

1 results

Finished
Energy Frontier Research Center For Inorganometallic Catalyst Design (DE-SC0012702)
Gagliardi, L. (PI), Cramer, C. (CoI), Lu, C. C. (CoI), Penn, L. (CoI), Stein, A. (CoI) & Truhlar, D. G. (CoI)
U.S. DEPARTMENT OF ENERGY (USDOE)
8/1/14 → 7/31/18
Project: Research project