“…The differences between the calculated and the experimental data are all well within experimental uncertainties. The standard deviation, σ, is calculated as 1.025 kJ/mol-atom according to the following formula: [28], Gartner [29], Davidson and Smith [30], Pyagai and Vakhobov [31], Smith and Smythe [26], Chiotti et al [27], and results from previous modeling [13] in dotted line (σ = 1.025 kJ/mol-atom).…”