2023
DOI: 10.1021/acs.jpcc.3c05180
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Controlled Hierarchical Dehydrogenation Reactions on Au(111)

Huaming Zhu,
Yuanjing Zheng,
Xing Fan
et al.

Abstract: X–H (X = N, C, O...) bonds are abundant among organic precursors; controllable scission of hydrogenation atoms with high selectivity, therefore, has acquired extensive interest. In this study, we successfully realized hierarchical dehydrogenation reactions on an inert Au(111) surface. With the introduction of Fe atoms, N–H bond activation takes place at 450 K, and C–H bond activation occurs at 660 K. The large temperature window leads to excellent reaction selectivity. Moreover, each dehydrogenation step is mo… Show more

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Cited by 1 publication
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“…μ H is the chemical potential of H, which can be obtained from half the energy of H 2 . The calculated dehydrogenation energy is 1.13 eV, which is consistent with the typical energy required for dehydrogenation in numerous organic molecules adsorbed on Au(111) surfaces . This indicates that the dehydrogenation reaction could occur in accordance with experimental observations.…”
Section: Resultssupporting
confidence: 83%
See 1 more Smart Citation
“…μ H is the chemical potential of H, which can be obtained from half the energy of H 2 . The calculated dehydrogenation energy is 1.13 eV, which is consistent with the typical energy required for dehydrogenation in numerous organic molecules adsorbed on Au(111) surfaces . This indicates that the dehydrogenation reaction could occur in accordance with experimental observations.…”
Section: Resultssupporting
confidence: 83%
“…The calculated dehydrogenation energy is 1.13 eV, which is consistent with the typical energy required for dehydrogenation in numerous organic molecules adsorbed on Au(111) surfaces. 39 This indicates that the dehydrogenation reaction could occur in accordance with experimental observations. Upon deposition on Au(111) held at 373 K, dehydrogenated 8OH-TPB molecules aggregate into a closely packed 2D island.…”
Section: ■ Results and Discussionsupporting
confidence: 83%