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Mohammadi, Mohsen Doust (author), Bhaskaran, Renjith (author), Abdullah, Hewa Y. (author), Abdallah, Hassan H. (author), Biskos, G. (author), Bhowmick, Somnath (author)
We have investigated the potential energy curves (PECs) of the LiN heteronuclear diatomic molecule, including its ionic species LiN<sup>+</sup> and LiN<sup>−</sup>, using explicitly correlated multi-reference configuration interaction (MRCI-F12) calculations in conjunction with the correlation consistent quintuple-𝜁 basis set. The effect of core...
journal article 2023