TY  - RPRT
TI  - DFT-based QM/MM with Particle-Mesh Ewald for Direct, Long-Range Electrostatic Embedding
AU  - Pederson, John P.
AU  - McDaniel, Jesse
PY  - 2022
DO  - 10.1063/5.0087386
UR  - https://www.osti.gov/biblio/1864706
ID  - 1864706
ER  -