Figure 3: Reactive force field calculations. | Nature Communications

Figure 3: Reactive force field calculations.

From: Aqueous proton transfer across single-layer graphene

Figure 3: Reactive force field calculations.The alternative text for this image may have been generated using AI.

Proton channel formation from ReaxFF calculations of water-mediated proton transfer through atomic defects terminated in six OH groups (a), four OH groups and one oxygen atom (b), two OH groups and two oxygen atoms (c), and three oxygen atoms (d). Denotations of spheres: grey=carbon; red=oxygen; white=hydrogen atoms.

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