Repulsive and bound parts of the interatomic potentials of the lowest singlet electronic energy states of the MeRg complexes (Me=Zn, Cd; Rg=He, Ne, Ar, Kr, Xe)

Effects of trapping site on the spectroscopy of 1P1 excited group 12 metal atoms in rare gas matrices

“…The potential energy curves of the 1 Σ and 1 Π molecular states [V Σ (R) and V Π (R)] have been deduced from both experimental and theoretical methods. [17][18][19][20][21][22][23][24][25][26][27][28][29][30][31][32] In the present study they are represented by Morse or anti-Morse potentials whose parameters are collected in Table II. The total interaction Hamiltonian, H M-RG , for the electronic states correlating with the metal atom states M( 1 S 0 ) or M( 1 P 1 ) is obtained as the sum of pairwise interactions:…”