TY - RPRT TI - Comparing Classical and Machine Learning Force Fields for Modeling Deformation of Metal–Organic Frameworks Relevant for Direct Air Capture AU - Brabson, Logan M. [Georgia Institute of Technology, Atlanta, GA (United States)] AU - Medford, Andrew J. [Georgia Institute of Technology, Atlanta, GA (United States)] (ORCID:0000000183119581) AU - Sholl, David S. [Oak Ridge National Laboratory (ORNL), Oak Ridge, TN (United States)] (ORCID:0000000227719168) PY - 2025 DO - 10.1021/acs.jpcc.5c04020 UR - https://www.osti.gov/biblio/2589308 ID - 2589308 ER -