Title : Tuning the Electronic Properties of Graphane via Hydroxylation: An Ab Initio Study.

Pub. Date : 2021 Jul 29

PMID : 34476036






1 Functional Relationships(s)
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1 The thermodynamic stability of hydroxylated graphane, that is, fully sp3 graphene derivatives coordinated with -H and -OH groups, has been recently demonstrated by ab initio calculations. Graphite Sp3 transcription factor Homo sapiens