TY - RPRT TI - Automation of Active Space Selection for Multireference Methods via Machine Learning on Chemical Bond Dissociation AU - Jeong, WooSeok AU - Stoneburner, Samuel J. AU - King, Daniel AU - Li, Ruye AU - Walker, Andrew AU - Lindh, Roland AU - Gagliardi, Laura PY - 2020 DO - 10.1021/acs.jctc.9b01297 UR - https://www.osti.gov/biblio/1712738 ID - 1712738 ER -