Table 2. Molecular Parameters^a for the X²Σ⁺ State of ²⁴MgH Determined using Various Potential Energy Functions and Derived from the Experimental Data.

	CVb	CV + Rc	CV + R + Dc	Exp.d
re (Å)	1.72948	1.72890	1.72928	1.729685
E + 200 (hartree)	–0.525839	–0.833431	–0.829159
De (cm–1)	11,183	11,115	11,101	11,104.3
ν (cm–1)	1433.98	1432.33	1431.76	1431.978
B0 (cm–1)	5.74130	5.74476	5.74223	5.736507

^aSee Table 1.

^bThe potential energy function was calculated at the MR-ACPF/aug-cc-pCV8Z level of theory, including the correction for enlargement of the basis set (see the text).

^cIncluding additional corrections for the scalar relativistic (R) and adiabatic (D) effects.

^dDerived from the experimental data in ref (4).