. 2014 Nov 12;136(49):17036–17045. doi: 10.1021/ja506385p

Table 2. Thermodynamic Characteristics Deduced from in Silico Indentations: Change in Enthalpy ΔH, Entropy TΔS, and Free Energy ΔG (with Standard Deviations) Associated with the Disruption of a Single Lateral Bond (Interface) and Longitudinal Bond^a.

interface	ΔG, kcal/mol	ΔH, kcal/mol	TΔS, kcal/mol
lateral	6.9 ± 0.4	9.3 ± 0.8	2.5 ± 0.7
longitudinal	14.9 ± 1.5	25.7 ± 2.2	10.8 ± 2.5

Averaging is performed over all indentation points (1–7, Figure 1C) and for 10 and 15 nm tip.

Table 2. Thermodynamic Characteristics Deduced from in Silico Indentations: Change in Enthalpy ΔH, Entropy TΔS, and Free Energy ΔG (with Standard Deviations) Associated with the Disruption of a Single Lateral Bond (Interface) and Longitudinal Bonda.