4 Experimental and Computational Methods The electrosynthesis of MoS 2 @NiFeCo-LDH and MoS 2 @NiFeCo-Mo(doped)-LDH was conducted using a similar procedure for both electrodes in a three-electrode cell setup under ambient temperature conditions, employing NiFeCo-LDH/NF and NiFeCo-Mo(doped)-LDH/NF (2 × 2 cm 2 ) as the working electrodes. A platinum plate and an Ag/AgCl electrode were used as the counter and reference electrodes, respectively. MoS 2 -QDs were electrodeposited on NiFeCo-LDH and