Figure 2 | Scientific Reports

Figure 2

From: Collision-induced activation: Towards industrially scalable approach to graphite nanoplatelets functionalization for superior polymer nanocomposites

Figure 2The alternative text for this image may have been generated using AI.

The electrostatic potential surface (ESP) generated at B97-D/6 − 31 + G* level of theory. Red and blue colors signify the regions with charge accumulation and depletion, respectively. Counterpoise corrected binding energies (E bind ) in kcal/mol, C-C bond lengths (d C1-C2 ) and binding distances (b bind ) in Å, for the studied GNP-maleic anhydride (MA) system.

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