Data for: "Revealing the Effect of sp<sup>3</sup> Carbons on Electronic and Optical Properties of Graphene Quantum Dots Using Density Functional Theory"
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Coordinates of structures and optical absorption calculations results (Gaussian .log format).The structures are based on the C54H18 graphene quantum dot and contain 1, 2 or 6 sp3 carbon atoms in various arrangements.
创建时间：
2024-07-25
