TY  - RPRT
TI  - Accurate Force Field for Carbon Dioxide–Silica Interactions Based on Density Functional Theory
AU  - Godahewa, Sahan M. [University of Kansas, Lawrence, KS (United States)]
AU  - Jayawardena, Thanuja [University of Kansas, Lawrence, KS (United States)]
AU  - Thompson, Ward H. [University of Kansas, Lawrence, KS (United States)] (ORCID:0000000236366448)
AU  - Greathouse, Jeffery A. [Sandia National Laboratories (SNL-NM), Albuquerque, NM (United States)] (ORCID:0000000242473362)
PY  - 2025
DO  - 10.1021/acs.jpcb.4c07413
UR  - https://www.osti.gov/biblio/2540228
ID  - 2540228
ER  -