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The ground state intermolecular potential of bimolecular complexes of N-heterocycles is analyzed for the impact of individual terms in the interaction energy as provided by various, conceptually different theories. Novel combinations with several for
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::1755abf597522dc326a1c305e401f9a6
https://doi.org/10.26434/chemrxiv-2021-gv8xk-v2
https://doi.org/10.26434/chemrxiv-2021-gv8xk-v2