2014
DOI: 10.1021/jp509659p
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Oxidation of a Graphite Surface: The Role of Water

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Cited by 23 publications
(19 citation statements)
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“…Projected augmented wave (PAW) method [16] is applied in this work. All calculations are performed using the local density approximation, which is feasible for modeling the graphite surface functionalization [17,18]. Interlayer distance is 3.35 Å by LDA approach and that is in good agreement with experimental value (3.33 Å) [19].…”
Section: Dft Calculation Methodssupporting
confidence: 67%
“…Projected augmented wave (PAW) method [16] is applied in this work. All calculations are performed using the local density approximation, which is feasible for modeling the graphite surface functionalization [17,18]. Interlayer distance is 3.35 Å by LDA approach and that is in good agreement with experimental value (3.33 Å) [19].…”
Section: Dft Calculation Methodssupporting
confidence: 67%
“…Surprisingly, by applying both CV and NPV close to the oxygen evolution potential (i.e., 0.87 V), XPS spectra show the typical intercalation features again. They are likely due to the oxidation of graphite-linked hydroxyl groups which tend to produce O 2 both at the surface and in the inner layers. , Because part of the hydroxyl group is oxidized, the amount of intercalation is lower compared to higher potentials, where the circulating current is higher, thus allowing for a massive ion intercalation …”
Section: Results and Discussionmentioning
confidence: 99%
“…According to SAXS results, the pre‐exfoliation of GrO in water with ultrasound allows the modification of the interlayer spacing to improve the good interaction between the GO and polymeric matrix of starch. The solution at 1 wt % of GrO was chosen for BNCs preparation because better GO monolayer intercalation/exfoliation facilitated a higher water content …”
Section: Resultsmentioning
confidence: 99%