Anionic behavior and single-molecule crystal in fullerene confinements A contribution from DFT energy decomposition and cooperativity analyses

par Alipour, Mojtaba
Publié dans: Journal of computational chemistry (2020)

Dipole moments of molecules with multi-reference character from optimally tuned range-separated density functional theory

par Alipour, Mojtaba
Publié dans: Journal of computational chemistry (2018)