Energy and spectroscopic parameters of neutral and cations isomers of the CnH2 (n = 2-6) families using high-level ab-initio approaches.

Sun, 01 Dec 2024 00:00:00 +0100

Lenin J. Díaz Soto , Ricardo R. Oliveira , Leonardo Baptista , Ênio Frota da Silveira, Marco Antonio Chaer Nascimento :
Energy and spectroscopic parameters of neutral and cations isomers of the CnH₂ (n = 2-6) families using high-level ab-initio approaches. J. Comput. Chem. 45(32): 2793-2804 (2024)