TY - RPRT TI - Evaluation of Density-Functional Tight-Binding Methods for Simulation of Protic Molecular Ion Pairs AU - Walker, Tyler [Univ. of Tennessee, Knoxville, TN (United States)] (ORCID:0000000270233702) AU - Vuong, Van‐Quan [Boston Univ., MA (United States)] (ORCID:0000000185808532) AU - Irle, Stephan [Oak Ridge National Laboratory (ORNL), Oak Ridge, TN (United States)] (ORCID:0000000349954991) AU - Ma, Jihong [Univ. of Vermont, Burlington, VT (United States)] (ORCID:0000000191428528) PY - 2025 DO - 10.1002/jcc.70064 UR - https://www.osti.gov/biblio/2516757 ID - 2516757 ER -