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Volumn 1, Issue 11, 2015, Pages

Chemistry: A single iron site confined in a graphene matrix for the catalytic oxidation of benzene at room temperature

Author keywords

[No Author keywords available]

Indexed keywords

ATOMS; BENZENE; BENZENE REFINING; CATALYSIS; DENSITY FUNCTIONAL THEORY; ELECTROCATALYSIS; ELECTRON MICROSCOPY; GRAPHENE; HIGH RESOLUTION TRANSMISSION ELECTRON MICROSCOPY; IRON; IRON COMPOUNDS; OXIDATION; PHENOLS; SCANNING ELECTRON MICROSCOPY; SCANNING TUNNELING MICROSCOPY; TEMPERATURE; TRANSMISSION ELECTRON MICROSCOPY;

EID: 85040165523     PISSN: None     EISSN: 23752548     Source Type: Journal    
DOI: 10.1126/sciadv.1500462     Document Type: Article
Times cited : (757)

References (61)
  • 1
    • 4644275807 scopus 로고    scopus 로고
    • Mechanism of oxidation reactions catalyzed by cytochrome P450 enzymes
    • B. Meunier, S. P. de Visser, S. Shaik, Mechanism of oxidation reactions catalyzed by cytochrome P450 enzymes. Chem. Rev. 104, 3947-3980 (2004).
    • (2004) Chem. Rev , vol.104 , pp. 3947-3980
    • Meunier, B.1    De Visser, S.P.2    Shaik, S.3
  • 2
    • 80052135332 scopus 로고    scopus 로고
    • Regio-A nd stereoselectivity of P450-catalysed hydroxylation of steroids controlled by laboratory evolution
    • S. Kille, F. E. Zilly, J. P. Acevedo, M. T. Reetz, Regio-A nd stereoselectivity of P450-catalysed hydroxylation of steroids controlled by laboratory evolution. Nat. Chem. 3, 738-743 (2011).
    • (2011) Nat. Chem , vol.3 , pp. 738-743
    • Kille, S.1    Zilly, F.E.2    Acevedo, J.P.3    Reetz, M.T.4
  • 3
    • 0000703950 scopus 로고    scopus 로고
    • Mechanism of molybdenum nitrogenase
    • B. K. Burgess, D. J. Lowe, Mechanism of molybdenum nitrogenase. Chem. Rev. 96, 2983-3012 (1996).
    • (1996) Chem. Rev , vol.96 , pp. 2983-3012
    • Burgess, B.K.1    Lowe, D.J.2
  • 4
    • 0037205915 scopus 로고    scopus 로고
    • Reactions of methane monooxygenase intermediate Q with derivatized methanes
    • E. A. Ambundo, R. A. Friesner, S. J. Lippard, Reactions of methane monooxygenase intermediate Q with derivatized methanes. J. Am. Chem. Soc. 124, 8770-8771 (2002).
    • (2002) J. Am. Chem. Soc , vol.124 , pp. 8770-8771
    • Ambundo, E.A.1    Friesner, R.A.2    Lippard, S.J.3
  • 5
    • 1842502865 scopus 로고    scopus 로고
    • Methane-to-methanol oxidation by the hydrated iron(IV) oxo species in aqueous solution: A combined DFT and Car-Parrinello molecular dynamics study
    • B. Ensing, F. Buda, M. C. M. Gribnau, E. J. Baerends, Methane-to-methanol oxidation by the hydrated iron(IV) oxo species in aqueous solution: A combined DFT and Car-Parrinello molecular dynamics study. J. Am. Chem. Soc. 126, 4355-4365 (2004).
    • (2004) J. Am. Chem. Soc , vol.126 , pp. 4355-4365
    • Ensing, B.1    Buda, F.2    Gribnau, M.C.M.3    Baerends, E.J.4
  • 8
    • 70349558828 scopus 로고    scopus 로고
    • Coordinatively unsaturated Al3+ centers as binding sites for active catalyst phases of platinum on g-Al2O3
    • J. H. Kwak, J. Hu, D. Mei, C.-W. Yi, D. H. Kim, C. H. F. Peden, L. F. Allard, J. Szanyi, Coordinatively unsaturated Al3+ centers as binding sites for active catalyst phases of platinum on g-Al2O3. Science 325, 1670-1673 (2009).
    • (2009) Science , vol.325 , pp. 1670-1673
    • Kwak, J.H.1    Hu, J.2    Mei, D.3    Yi, C.-W.4    Kim, D.H.5    Peden, C.H.F.6    Allard, L.F.7    Szanyi, J.8
  • 9
    • 0000452823 scopus 로고    scopus 로고
    • Generation of active oxygen species on solid surfaces. Opportunity for novel oxidation technologies over zeolites
    • G. I. Panov, A. K. Uriarte, M. A. Rodkin, V. I. Sobolev, Generation of active oxygen species on solid surfaces. Opportunity for novel oxidation technologies over zeolites. Catal. Today 41, 365-385 (1998).
    • (1998) Catal. Today , vol.41 , pp. 365-385
    • Panov, G.I.1    Uriarte, A.K.2    Rodkin, M.A.3    Sobolev, V.I.4
  • 10
    • 34447275466 scopus 로고    scopus 로고
    • Structure and nuclearity of active sites in Fe-zeolites: Comparison with iron sites in enzymes and homogeneous catalysts
    • A. Zecchina, M. Rivallan, G. Berlier, C. Lamberti, G. Ricchiardi, Structure and nuclearity of active sites in Fe-zeolites: Comparison with iron sites in enzymes and homogeneous catalysts. Phys. Chem. Chem. Phys. 9, 3483-3499 (2007).
    • (2007) Phys. Chem. Chem. Phys , vol.9 , pp. 3483-3499
    • Zecchina, A.1    Rivallan, M.2    Berlier, G.3    Lamberti, C.4    Ricchiardi, G.5
  • 11
    • 84898715895 scopus 로고    scopus 로고
    • The concept, reality and utility of single-site heterogeneous catalysts (SSHCs)
    • J. M. Thomas, The concept, reality and utility of single-site heterogeneous catalysts (SSHCs). Phys. Chem. Chem. Phys. 16, 7647-7661 (2014).
    • (2014) Phys. Chem. Chem. Phys , vol.16 , pp. 7647-7661
    • Thomas, J.M.1
  • 13
    • 84882676257 scopus 로고    scopus 로고
    • Interface-confined oxide nanostructures for catalytic oxidation reactions
    • Q. Fu, F. Yang, X. Bao, Interface-confined oxide nanostructures for catalytic oxidation reactions. Acc. Chem. Res. 46, 1692-1701 (2013).
    • (2013) Acc. Chem. Res , vol.46 , pp. 1692-1701
    • Fu, Q.1    Yang, F.2    Bao, X.3
  • 15
    • 75649121098 scopus 로고    scopus 로고
    • Honeycomb carbon: A review of graphene
    • M. J. Allen, V. C. Tung, R. B. Kaner, Honeycomb carbon: A review of graphene. Chem. Rev. 110, 132-145 (2010).
    • (2010) Chem. Rev , vol.110 , pp. 132-145
    • Allen, M.J.1    Tung, V.C.2    Kaner, R.B.3
  • 19
    • 52649175988 scopus 로고    scopus 로고
    • Phthalocyanines: From outstanding electronic properties to emerging applications
    • C. G. Claessens, U. Hahn, T. Torres, Phthalocyanines: From outstanding electronic properties to emerging applications. Chem. Rec. 8, 75-97 (2008).
    • (2008) Chem. Rec , vol.8 , pp. 75-97
    • Claessens, C.G.1    Hahn, U.2    Torres, T.3
  • 20
    • 80052325172 scopus 로고    scopus 로고
    • Size effect of graphene on electrocatalytic activation of oxygen
    • D. Deng, L. Yu, X. Pan, S. Wang, X. Chen, P. Hu, L. Sun, X. Bao, Size effect of graphene on electrocatalytic activation of oxygen. Chem. Commun. 47, 10016-10018 (2011).
    • (2011) Chem. Commun , vol.47 , pp. 10016-10018
    • Deng, D.1    Yu, L.2    Pan, X.3    Wang, S.4    Chen, X.5    Hu, P.6    Sun, L.7    Bao, X.8
  • 21
    • 84914175583 scopus 로고    scopus 로고
    • Enhanced thermal oxidation stability of reduced graphene oxide by nitrogen doping
    • S. Sandoval, N. Kumar, A. Sundaresan, C. N. R. Rao, A. Fuertes, G. Tobias, Enhanced thermal oxidation stability of reduced graphene oxide by nitrogen doping. Chem. Eur. J. 20, 11999-12003 (2014).
    • (2014) Chem. Eur. J , vol.20 , pp. 11999-12003
    • Sandoval, S.1    Kumar, N.2    Sundaresan, A.3    Rao, C.N.R.4    Fuertes, A.5    Tobias, G.6
  • 22
    • 29244490575 scopus 로고    scopus 로고
    • Nanostructured graphite prepared by ball-milling at low temperatures
    • M. Hentsche, H. Hermann, T. Gemming, H. Wendrock, K. Wetzig, Nanostructured graphite prepared by ball-milling at low temperatures. Carbon 44, 812-814 (2006).
    • (2006) Carbon , vol.44 , pp. 812-814
    • Hentsche, M.1    Hermann, H.2    Gemming, T.3    Wendrock, H.4    Wetzig, K.5
  • 24
    • 84887952781 scopus 로고    scopus 로고
    • An orders-of-magnitude increase in the rate of the solid-catalyzed CO oxidation by in situ ball milling
    • S. Immohr, M. Felderhoff, C. Weidenthaler, F. Schüth, An orders-of-magnitude increase in the rate of the solid-catalyzed CO oxidation by in situ ball milling. Angew. Chem. Int. Ed. 52, 12688-12691 (2013).
    • (2013) Angew. Chem. Int. Ed , vol.52 , pp. 12688-12691
    • Immohr, S.1    Felderhoff, M.2    Weidenthaler, C.3    Schüth, F.4
  • 25
    • 79959261568 scopus 로고    scopus 로고
    • Coverage-driven electronic decoupling of Fe-phthalocyanine from a Ag(111) substrate
    • T. G. Gopakumar, T. Brumme, J. Kröger, C. Toher, G. Cuniberti, R. Berndt, Coverage-driven electronic decoupling of Fe-phthalocyanine from a Ag(111) substrate. J. Phys. Chem. C 115, 12173-12179 (2011).
    • (2011) J. Phys. Chem. C , vol.115 , pp. 12173-12179
    • Gopakumar, T.G.1    Brumme, T.2    Kröger, J.3    Toher, C.4    Cuniberti, G.5    Berndt, R.6
  • 26
    • 84886670267 scopus 로고    scopus 로고
    • Enhancement of inelastic electron tunneling conductance caused by electronic decoupling in iron phthalocyanine bilayer on Ag(111)
    • N. Ohta, R. Arafune, N. Tsukahara, M. Kawai, N. Takagi, Enhancement of inelastic electron tunneling conductance caused by electronic decoupling in iron phthalocyanine bilayer on Ag(111). J. Phys. Chem. C 117, 21832-21837 (2013).
    • (2013) J. Phys. Chem. C , vol.117 , pp. 21832-21837
    • Ohta, N.1    Arafune, R.2    Tsukahara, N.3    Kawai, M.4    Takagi, N.5
  • 30
    • 0034691021 scopus 로고    scopus 로고
    • In situ structural investigation of iron phthalocyanine monolayer adsorbed on electrode surface by X-ray absorption fine structure
    • S. Kim, T. Ohta, G. Kwag, In situ structural investigation of iron phthalocyanine monolayer adsorbed on electrode surface by X-ray absorption fine structure. Bull. Korean Chem. Soc. 21, 588-594 (2000).
    • (2000) Bull. Korean Chem. Soc , vol.21 , pp. 588-594
    • Kim, S.1    Ohta, T.2    Kwag, G.3
  • 31
    • 0035958457 scopus 로고    scopus 로고
    • Electrochemical and XAFS investigation of nitrite reduction by heat-treated m-oxo derivative of iron phthalocyanine supported on high area carbon
    • H. J. Choi, G. Kwag, S. Kim, Electrochemical and XAFS investigation of nitrite reduction by heat-treated m-oxo derivative of iron phthalocyanine supported on high area carbon. J. Electroanal. Chem. 508, 105-114 (2001).
    • (2001) J. Electroanal. Chem , vol.508 , pp. 105-114
    • Choi, H.J.1    Kwag, G.2    Kim, S.3
  • 33
    • 65549133635 scopus 로고    scopus 로고
    • Filling empty states in a CuPc single layer on the Au(110) surface via electron injection
    • A. Calabrese, L. Floreano, A. Verdini, C. Mariani, M. G. Betti, Filling empty states in a CuPc single layer on the Au(110) surface via electron injection. Phys. Rev. B 79, 115446 (2009).
    • (2009) Phys. Rev. B , vol.79 , pp. 115446
    • Calabrese, A.1    Floreano, L.2    Verdini, A.3    Mariani, C.4    Betti, M.G.5
  • 34
    • 0003165802 scopus 로고
    • High-resolution soft X-ray excitation spectra of 3d-metal phthalocyanines
    • E. E. Koch, Y. Jugnet, F. J. Himpsel, High-resolution soft X-ray excitation spectra of 3d-metal phthalocyanines. Chem. Phys. Lett. 116, 7-11 (1985).
    • (1985) Chem. Phys. Lett , vol.116 , pp. 7-11
    • Koch, E.E.1    Jugnet, Y.2    Himpsel, F.J.3
  • 37
    • 0345926039 scopus 로고
    • Titanium-containing mesoporous molecular sieves for catalytic oxidation of aromatic compounds
    • P. T. Tanev, M. Chibwe, T. J. Pinnavaia, Titanium-containing mesoporous molecular sieves for catalytic oxidation of aromatic compounds. Nature 368, 321-323 (1994).
    • (1994) Nature , vol.368 , pp. 321-323
    • Tanev, P.T.1    Chibwe, M.2    Pinnavaia, T.J.3
  • 40
    • 84871657031 scopus 로고    scopus 로고
    • Highly selective synthesis of phenol from benzene over a vanadium-doped graphitic carbon nitride catalyst
    • G. Ding, W. Wang, T. Jiang, B. Han, H. Fan, G. Yang, Highly selective synthesis of phenol from benzene over a vanadium-doped graphitic carbon nitride catalyst. ChemCatChem 5, 192-200 (2013).
    • (2013) ChemCatChem , vol.5 , pp. 192-200
    • Ding, G.1    Wang, W.2    Jiang, T.3    Han, B.4    Fan, H.5    Yang, G.6
  • 41
    • 84875855574 scopus 로고    scopus 로고
    • Direct catalytic oxidation of benzene to phenol over metal-free graphene-based catalyst
    • J.-H. Yang, G. Sun, Y. Gao, H. Zhao, P. Tang, J. Tan, A.-H. Lu, D. Ma, Direct catalytic oxidation of benzene to phenol over metal-free graphene-based catalyst. Energy Environ. Sci. 6, 793-798 (2013).
    • (2013) Energy Environ. Sci , vol.6 , pp. 793-798
    • Yang, J.-H.1    Sun, G.2    Gao, Y.3    Zhao, H.4    Tang, P.5    Tan, J.6    Lu, A.-H.7    Ma, D.8
  • 42
    • 84876711979 scopus 로고    scopus 로고
    • Enhancing chemical reactions in a confined hydrophobic environment: An NMR study of benzene hydroxylation in carbon nanotubes
    • H. Zhang, X. Pan, X. Han, X. Liu, X. Wang, W. Shen, X. Bao, Enhancing chemical reactions in a confined hydrophobic environment: An NMR study of benzene hydroxylation in carbon nanotubes. Chem. Sci. 4, 1075-1078 (2013).
    • (2013) Chem. Sci , vol.4 , pp. 1075-1078
    • Zhang, H.1    Pan, X.2    Han, X.3    Liu, X.4    Wang, X.5    Shen, W.6    Bao, X.7
  • 43
    • 0000278545 scopus 로고    scopus 로고
    • Iron-phthalocyanine immobilized on activated carbon black: A selective catalyst for alkane oxidation
    • R. F. Parton, P. E. Neys, P. A. Jacobs, R. C. Sosa, P. G. Rouxhet, Iron-phthalocyanine immobilized on activated carbon black: A selective catalyst for alkane oxidation. J. Catal. 164, 341-346 (1996).
    • (1996) J. Catal , vol.164 , pp. 341-346
    • Parton, R.F.1    Neys, P.E.2    Jacobs, P.A.3    Sosa, R.C.4    Rouxhet, P.G.5
  • 44
    • 36749117688 scopus 로고
    • Electron acceptor surface states due to oxygen adsorption on metal phthalocyanine films
    • S. C. Dahlberg, M. E. Musser, Electron acceptor surface states due to oxygen adsorption on metal phthalocyanine films. J. Chem. Phys. 72, 6706-6711 (1980).
    • (1980) J. Chem. Phys , vol.72 , pp. 6706-6711
    • Dahlberg, S.C.1    Musser, M.E.2
  • 46
    • 12844286241 scopus 로고
    • Ab initio molecular dynamics for liquid metals
    • G. Kresse, J. Hafner, Ab initio molecular dynamics for liquid metals. Phys. Rev. B 47, 558-561 (1993).
    • (1993) Phys. Rev. B , vol.47 , pp. 558-561
    • Kresse, G.1    Hafner, J.2
  • 47
    • 27744460065 scopus 로고
    • Ab initio molecular-dynamics simulation of the liquid-metal-amorphoussemiconductor transition in germanium
    • G. Kresse, J. Hafner, Ab initio molecular-dynamics simulation of the liquid-metal-amorphoussemiconductor transition in germanium. Phys. Rev. B 49, 14251-14269 (1994).
    • (1994) Phys. Rev. B , vol.49 , pp. 14251-14269
    • Kresse, G.1    Hafner, J.2
  • 48
    • 0030190741 scopus 로고    scopus 로고
    • Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set
    • G. Kresse, J. Furthmüller, Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set. Comput. Mater. Sci. 6, 15-50 (1996).
    • (1996) Comput. Mater. Sci , vol.6 , pp. 15-50
    • Kresse, G.1    Furthmüller, J.2
  • 49
    • 25744460922 scopus 로고
    • Projector augmented-wave method
    • P. E. Blöchl, Projector augmented-wave method. Phys. Rev. B 50, 17953-17979 (1994).
    • (1994) Phys. Rev. B , vol.50 , pp. 17953-17979
    • Blöchl, P.E.1
  • 50
    • 0011236321 scopus 로고    scopus 로고
    • From ultrasoft pseudopotentials to the projector augmented-wave method
    • G. Kresse, D. Joubert, From ultrasoft pseudopotentials to the projector augmented-wave method. Phys. Rev. B 59, 1758-1775 (1999).
    • (1999) Phys. Rev. B , vol.59 , pp. 1758-1775
    • Kresse, G.1    Joubert, D.2
  • 51
    • 4243943295 scopus 로고    scopus 로고
    • Generalized gradient approximation made simple
    • J. P. Perdew, K. Burke, M. Ernzerhof, Generalized gradient approximation made simple. Phys. Rev. Lett. 77, 3865-3868 (1996).
    • (1996) Phys. Rev. Lett , vol.77 , pp. 3865-3868
    • Perdew, J.P.1    Burke, K.2    Ernzerhof, M.3
  • 53
    • 1842816907 scopus 로고
    • Special points for Brillouin-zone integrations
    • H. J. Monkhorst, J. D. Pack, Special points for Brillouin-zone integrations. Phys. Rev. B 13, 5188-5192 (1976).
    • (1976) Phys. Rev. B , vol.13 , pp. 5188-5192
    • Monkhorst, H.J.1    Pack, J.D.2
  • 54
    • 0008293429 scopus 로고    scopus 로고
    • CO oxidation on Pt(111): An ab initio density functional theory study
    • A. Alavi, P. Hu, T. Deutsch, P. L. Silvestrelli, J. Hutter, CO oxidation on Pt(111): An ab initio density functional theory study. Phys. Rev. Lett. 80, 3650-3653 (1998).
    • (1998) Phys. Rev. Lett , vol.80 , pp. 3650-3653
    • Alavi, A.1    Hu, P.2    Deutsch, T.3    Silvestrelli, P.L.4    Hutter, J.5
  • 55
    • 0034638411 scopus 로고    scopus 로고
    • Insight into microscopic reaction pathways in heterogeneous catalysis
    • A. Michaelides, P. Hu, Insight into microscopic reaction pathways in heterogeneous catalysis. J. Am. Chem. Soc. 122, 9866-9867 (2000).
    • (2000) J. Am. Chem. Soc , vol.122 , pp. 9866-9867
    • Michaelides, A.1    Hu, P.2
  • 56
    • 0037442338 scopus 로고    scopus 로고
    • General rules for predicting where a catalytic reaction should occur on metal surfaces: A density functional theory study of C-H and C-O bond breaking/making on flat, stepped, and kinked metal surfaces
    • Z.-P. Liu, P. Hu, General rules for predicting where a catalytic reaction should occur on metal surfaces: A density functional theory study of C-H and C-O bond breaking/making on flat, stepped, and kinked metal surfaces. J. Am. Chem. Soc. 125, 1958-1967 (2003).
    • (2003) J. Am. Chem. Soc , vol.125 , pp. 1958-1967
    • Liu, Z.-P.1    Hu, P.2
  • 57
    • 0032370284 scopus 로고    scopus 로고
    • WinXAS: A program for X-ray absorption spectroscopy data analysis under MSWindows
    • T. Ressler, WinXAS: A program for X-ray absorption spectroscopy data analysis under MSWindows. J. Synchrotron Radiat. 5, 118-122 (1998).
    • (1998) J. Synchrotron Radiat , vol.5 , pp. 118-122
    • Ressler, T.1
  • 58
    • 0542395209 scopus 로고    scopus 로고
    • Real-space multiple-scattering calculation and interpretation of X-ray-absorption near-edge structure
    • A. L. Ankudinov, B. Ravel, J. J. Rehr, S. D. Conradson, Real-space multiple-scattering calculation and interpretation of X-ray-absorption near-edge structure. Phys. Rev. B 58, 7565-7576 (1998).
    • (1998) Phys. Rev. B , vol.58 , pp. 7565-7576
    • Ankudinov, A.L.1    Ravel, B.2    Rehr, J.J.3    Conradson, S.D.4
  • 61
    • 77952960308 scopus 로고    scopus 로고
    • Freestanding graphene by thermal splitting of silicon carbide granules
    • D. Deng, X. Pan, H. Zhang, Q. Fu, D. Tan, X. Bao, Freestanding graphene by thermal splitting of silicon carbide granules. Adv. Mater. 22, 2168-2171 (2010).
    • (2010) Adv. Mater , vol.22 , pp. 2168-2171
    • Deng, D.1    Pan, X.2    Zhang, H.3    Fu, Q.4    Tan, D.5    Bao, X.6


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