Fig. 3From: A comprehensive understanding of the chemical vapour deposition of cadmium chalcogenides using Cd[(C6H5)2PSSe]2 single-source precursor: a density functional theory approachEnergy profile of the decomposition pathway of (C6H5)PSSe–Cd–S intermediate. Data in the path are the relative Gibbs free energies (in kcal/mol and bond distances in angstroms) obtained at M06/6-31G(d) levelBack to article page