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Hybrid-Basis Close-Coupling Interface to Quantum Chemistry Packages for the Treatment of Ionization Problems

Research areaMathematics, Physics and Engineering
TitleHybrid-Basis Close-Coupling Interface to Quantum Chemistry Packages for the Treatment of Ionization Problems
Publication TypeJournal Article
Publication year2017
AuthorsMarante, C, Klinker, M, Corral, I, Gonzalez-Vazquez, J, Argenti, L, Martin, F
JournalJournal of Chemical Theory and Computation
DOI10.1021/acs.jctc.6b00907