@misc{indiciae4e52381dbd89, title = {Assessing the Performance of Exchange‐Correlation Density Functionals in Describing the Iron‐Catalyzed Ammonia Synthesis System}, author = {Smith, Evangelos [Univ. of Wisconsin, Madison, WI (United States)] and Figueras‐Valls, Marc [Univ. of Wisconsin, Madison, WI (United States)] and Mavrikakis, Manos [Univ. of Wisconsin, Madison, WI (United States)] (ORCID:0000000252935356)}, year = {2025}, doi = {10.1002/ceur.202500030}, url = {https://www.osti.gov/biblio/3012736}, note = {Source identifier: 3012736} }