CARBON 5 0 ( 2 0 1 2 ) 3 2 1 0 –3 2 2 8 Available at www.sciencedirect.com journal homepage: www.elsevier.com/locate/carbon The reduction of graphene oxide Songfeng Pei, Hui-Ming Cheng * Shenyang National Laboratory for Materials Science, Institute of Metal Research, Chinese Academy of Sciences, 72 Wenhua Road, Shenyang 110016, China A R T I C L E I N F O A B S T R A C T Article history: Graphene has attracted great interest for its excellent mechanical, electrical, thermal and Received 28 September 2011 optical properties. It can be produced by micro-mechanical exfoliation of highly ordered Accepted 8 November 2011 pyrolytic graphite, epitaxial growth, chemical vapor deposition, and the reduction of graph- Available online 16 November 2011 ene oxide (GO). The first three methods can produce graphene with a relatively perfect structure and excellent properties, while in comparison, GO has two important characteristics: (1) it can be produced using inexpensive graphite as raw material by cost-effective chemical methods with a high yield, and (2) it is highly hydrophilic and can form stable aqueous colloids to facilitate the assembly of macroscopic structures by simple and cheap solution processes, both of which are important to the large-scale uses of graphene. A key topic in the research and applications of GO is the reduction, which partly restores the structure and properties of graphene. Different reduction processes result in different properties of reduced GO (rGO), which in turn affect the final performance of materials or devices composed of rGO. In this contribution, we review the state-of-art status of the reduction of GO on both techniques and mechanisms. The development in this field will speed the applications of graphene. 2011 Elsevier Ltd. All rights reserved. 1. Introduction A report in 2004 by Geim and Novoselov et al. of a method to prepare individual graphene sheets has initiated enormous scientific activity [1–3]. Graphene is a two dimensional (2D) crystal that is stable under ambient conditions; it has a special electronic structure, which gives it unusual electronic properties such as the anomalous quantum Hall effect [4] and astonishing high carrier mobility at relatively high charge carrier concentrations and at room temperature [1,5]. As a new material, the uses of graphene are very attractive since many interesting properties, mechanical [6], thermal [7] and electrical [8] have been reported to confirm the superiority of graphene to traditional materials [9]. Following this trend, graphite oxide, first reported over 150 years ago [10], has re-emerged as an intense research interest due to its role as a precursor for the cost-effective and mass production of graphene-based materials. Graphite oxide has a similar layered structure to graphite, but the plane of carbon atoms in graphite oxide is heavily decorated by oxygen-containing groups, which not only expand the interlayer distance but also make the atomic-thick layers hydrophilic. As a result, these oxidized layers can be exfoliated in water under moderate ultrasonication. If the exfoliated sheets contain only one or few layers of carbon atoms like graphene, these sheets are named graphene oxide (GO).1 The most attractive property of GO is that it can be (partly) reduced to graphene-like sheets by removing the oxygen-containing groups with the recovery of a conjugated structure. The reduced GO (rGO) sheets are usually considered as one kind of chemically derived graphene. Some other names have also been given to rGO, such as functionalized * Corresponding author: Fax: +86 24 2390 3126. E-mail address: cheng@imr.ac.cn (H.-M. Cheng). 1 ‘GO’ in this paper refers only to graphene oxide, while graphite oxide is not abbreviated in this paper. 0008-6223/$ - see front matter 2011 Elsevier Ltd. All rights reserved. doi:10.1016/j.carbon.2011.11.010 5 0 ( 20 1 2 ) 3 2 1 0–32 2 8 graphene, chemically modified graphene, chemically converted graphene, or reduced graphene [11]. The most straightforward goal of any reduction protocol is to produce graphene-like materials similar to the pristine graphene obtained from direct mechanical exfoliation (i.e. the ‘‘Scotch tape method’’) of individual layers of graphite both in structure and properties. Though numerous efforts have been made, the final target is still a dream. Residual functional groups and defects dramatically alter the structure of the carbon plane, therefore, it is not appropriate to refer to rGO, even today, simply as graphene since the properties are substantially different. Nowadays, in addition to reduction from GO, graphene can be produced by micro-mechanical exfoliation of highly ordered pyrolytic graphite [1], epitaxial growth [12–14], and chemical vapor deposition (CVD) [13,15,16]. These three methods can produce graphene with a relatively perfect structure and excellent properties. While in comparison, GO has two important characteristics: (1) it can be produced using inexpensive graphite as raw material by cost-effective chemical methods with a high yield, and (2) it is highly hydrophilic and can form stable aqueous colloids to facilitate the assembly of macroscopic structures by simple and cheap solution processes, both of which are important to the large-scale uses of graphene. As a result, GO and rGO are still hot topics in the research and development of graphene, especially in regard to mass applications. Therefore, the reduction of GO is definitely a key topic, and different reduction processes result in different properties that in turn affect the final performance of materials or devices composed of rGO. Though the final target to achieve perfect graphene is hard to reach, research efforts have continuously made it closer. Here we review work on the reduction of GO, and because there are many review papers on synthesis methods [13,17–23], and the physical [2,3,24– 26] and chemical [9,27–31] characteristics of graphene, details on them will not be repeated. 2. Preparation and characteristics of GO GO was firstly reported in 1840 by Schafhaeutl [10] and 1859 by Brodie [32]. The history of the evolution of synthesis methods and chemical structure of GO has been extensively reviewed by Dreyer et al. [9] and Compton and Nguyen [19]. Currently, GO is prepared mostly based on the method proposed by Hummers and Offeman [33] in 1958, where the oxidation of graphite to graphite oxide is accomplished by treating graphite with a water-free mixture of concentrated sulfuric acid, sodium nitrate and potassium permanganate. Though some modification has been proposed [34–37], the main strategy is unchanged. As a result, these methods are usually named modified Hummers methods. Though it has been developed for over a century, the precise chemical structure of GO is still not quite clear, which contributes to the complexity of GO due to its partial amorphous character. Several early investigations have proposed structural models of GO with a regular lattice composed of discrete repeat units [38], and the widely accepted GO model proposed by Lerf and Klinowski [39,40] is a nonstoichiometric 3211 model (shown in Fig. 1), wherein the carbon plane is decorated with hydroxyl and epoxy (1,2-ether) functional groups. Carbonyl groups are also present, most likely as carboxylic acids along the sheet edge but also as organic carbonyl defects within the sheet. Recent nuclear magnetic resonance (NMR) spectroscopy studies [41,42] of GO have made slight modifications to the proposed structure including the presence of 5and 6-membered lactols on the periphery of graphitic platelets as well as the presence of esters and tertiary alcohols on the surface, though epoxy and alcohol groups on the plane are still dominant. More detailed information on this evolution can be found in the review by Dreyer et al. [9]. An ideal sheet of graphene consists of only trigonally bonded sp2 carbon atoms and is perfectly flat [43] apart from microscopic ripples [44]. The heavily decorated GO sheets consist partly of tetrahedrally bonded sp3 carbon atoms, which are displaced slightly above or below the graphene plane [45]. Due to the structure deformation and the presence of covalentlybonded functional groups, GO sheets are atomically rough [46–48]. Mkhoyan et al. [47] examined the oxygen distribution on a GO monolayer using high-resolution annular dark field (ADF) imaging in a scanning transmission electron microscope (STEM), as shown in Fig. 2. The results indicate that the degree of oxidation fluctuates at the nanometer-scale, suggesting the presence of sp2 and sp3 carbon clusters of a few nanometers. Several groups [46,49–51] have studied the surface of GO with scanning tunneling microscopy (STM) and observed highly defective regions, probably due to the presence of oxygen and other areas are nearly intact. Surprisingly, a report shows that the graphene-like honeycomb lattice in GO is preserved, albeit with disorder, that is, the carbon atoms attached to functional groups are slightly displaced but the overall size of the unit cell in GO remains similar to that of graphene [52]. As a result, GO can be described as a random distribution of oxidized areas with oxygen-containing functional groups, combined with non-oxidized regions where most of the carbon atoms preserve sp2 hybridization. The conductivity of graphene mainly relies on the longrange conjugated network of the graphitic lattice [53,54]. Functionalization breaks the conjugated structure and localizes p-electrons, which results in a decrease of both carrier mobility and carrier concentration. Though there are conjugated areas in GO, long-range (>lm) conductivity is Copyright 1998 Elsevier. 1998 CARBON Fig. 1 – Lerf–Klinowski model of GO with the omission of minor groups (carboxyl, carbonyl, ester, etc.) on the periphery of the carbon plane of the graphitic platelets of GO [39,40]. 3212 5 0 ( 2 0 1 2 ) 3 2 1 0 –3 2 2 8 Copyright 2009 ACS. 2009 CARBON Fig. 2 – (a) AFM image of GO sheets. (b) STEM-ADF image of a GO film where mono-, bi- and tri-layers are labeled as a, b, and c. The round opening in the middle is a hole through the single film. (c) High-magnification ADF image of a monolayer GO film. (d) Simple drawing of monolayer and possible packing of bi- and tri-layers [47]. 3. Criteria used in determining the effect of reduction Since reduction can make a great change in the microstructure and properties of GO, some obvious changes can be directly observed or measured to judge the reducing effect of different reduction processes. 3.1. Visual characteristics Optical observation is a direct way to see the changes in GO before and after reduction. Since a reduction process can dramatically improve the electrical conductivity of GO, the increased charge carrier concentration and mobility will improve the reflection to incident light, which makes a rGO film have a metallic luster compared to its GO film precursor with a brown color and semi-transparency, as shown in Fig. 3a. The reduction in a colloid state by chemical reduction, e.g. hydrazine reduction, usually results in a black precipitation from the original yellow–brown suspension, which is probably a result of an increase in the hydrophobicity of the Copyright 2010 ACS. 2010 blocked by the absence of percolating pathways between sp2 carbon clusters to allow classical carrier transport to occur. As a result, as-synthesized GO sheets or films are typically insulating, exhibiting a sheet resistance of about 1012 X/sq or higher [34,55]. The attached groups and lattice defects modify the electronic structure of graphene and serve as strong scattering centers that affect the electrical transport. Therefore, the reduction of GO is not only concerned with removing the oxygen-containing groups bonded to the graphene and removing other atomic-scale lattice defects, but is also aimed at recovering the conjugated network of the graphitic lattice. These structure changes result in the recovery of electrical conductivity and other properties of graphene. Fig. 3 – Typical optical images of (a) a GO film and rGO film [58], Copyright 2011 Elsevier. (b) GO solution and rGO solution [59], Copyright 2009 ACS. (c, d) GO and rGO sheets on a 300 nm SiO2/Si substrate [34]. 5 0 ( 20 1 2 ) 3 2 1 0–32 2 8 material caused by a decrease in polar functionality on the surface of the sheets [56]. To improve the processibility of rGO, some strategies have been proposed to keep the colloid state by adding surfactants or adjusting solvent properties, while the change in color to black can be an obvious visible characteristic of the effect of reduction, as shown in Fig. 3b. The related change can be also observed on the microscale by optical microscopy of GO/rGO sheets lying on a properlyselected substrate like a SiO2/Si wafer. As shown in Fig. 3c and d, the as-prepared GO sheets are almost transparent with a very subtle optical contrast with the substrate, which confirms the insulating nature of the GO sheets. The small blue regions near the edges, corresponding to a larger thickness, are attributed to the commonly-observed edge folding [57], while after reduction, the rGO sheets show much improved contrast with the substrate, which is the same as that of pristine graphene sheets lying on the same substrate. 3.2. Electrical conductivity Graphene is reported to have a high electrical conductivity. A few-layer graphene sheet (thickness < 3 nm) has a sheet resistance (Rs) of around 400 X/sq at room temperature [1]. Recently, Bae et al. [60] have reported the production of graphene films by CVD. After transferring them to transparent substrate, a graphene-based transparent conductive film (TCF) composed of 4 layers has a sheet resistance of around 30 X/sq with transparency around 90% [60]. Assuming the film thickness was 2 nm, the calculated bulk conductivity of this film is 1.6 · 105 S/cm (107 S/m), which is much higher than for indium tin oxide (ITO) or metal films with the same thickness [61]. Since the purpose of reduction is mainly to restore the high conductivity of graphene, the electrical conductivity of rGO can be a direct criterion to judge the effect of different reduction methods. The electrical conductivity of rGO can be described in several ways: Rs of an individual rGO sheet (Rs-is), Rs of a thin film assembly of rGO sheets (Rs-f), powder conductivity (rp) and bulk conductivity (r) of rGO. Sheet resistance (Rs; X/sq) is a measure of the electrical resistance of a sheet, independent of its thickness. It is related to bulk conductivity by Eq. (1), where r is bulk conductivity (unit: S/cm) and t is sample thickness (unit: cm): Rs ¼ 1 rt 3213 reduction of hydroiodic acid (HI) [34] with a transparency of 78% at 550 nm wavelength, the calculated bulk conductivity of the film is about 1190 S/cm. Stankovich et al. [56] has used powder conductivity to describe the conductivity of rGO. In their measurement, rGO powders are compressed to pellets with different apparent densities and then measured by a two-probe method [56]. 3.3. Carbon to oxygen atomic ratio (C/O ratio) Depending on the preparation method, GO with chemical compositions ranging from C8O2H3 to C8O4H5, corresponding to a C/O ratio of 4:1–2:1, is typically produced [38,64,65]. After reduction, the C/O ratio can be improved to approximately 12:1 in most cases [45,66], but values as large as 246:1 have been recently reported [42]. The C/O ratio is usually obtained through elemental analysis measurements by combustion, and also by X-ray photoelectron spectrometry (XPS) analysis. It has been proved that the data obtained by elemental analysis are reasonably consistent with the data by XPS, considering the fact that elemental analysis gives the bulk composition while XPS is a surface analysis technique [45]. Furthermore, XPS spectra can give more information on the chemical structures of GO and rGO. Since it is p-electrons from the sp2 carbon that largely determine the optical and electrical properties of carbonbased materials [67], the fraction of sp2 bonding can provide insight into structure–property relationships. Briefly, as shown in Fig. 4, the C1s XPS spectrum of GO clearly indicates a considerable degree of oxidation with four components that correspond to carbon atoms in different functional groups: the non-oxygenated ring C (284.6 eV), the C in C–O bonds (286.0 eV), the carbonyl C (287.8 eV), and the carboxylate carbon (O–C = O, 289.0 eV) [68]. Although the C1s XPS spectrum of rGO also exhibits these oxygen functional groups, their peak intensities are much weaker than those in GO. Table 1 summarizes the electrical conductivity and C/O ratio of typical reports on the reduction of GO. The details on each reduction method will be discussed in Section 4. ð1Þ Rs-is can be measured by a two-probe method or four-probe method using an in situ fabricated microelectrode pair on an individual rGO sheet with the assistance of delicate photo- or electro-lithography. The lowest Rs-is was reported to be about 14 kX/sq (350 S/cm) by Lopez et al. [62], about two order higher than that of pristine graphene [1]. The highest bulk conductivity of a rGO sheet was reported to be 1314 S/cm by Su et al. [63]. Both values are obtained from rGO by thermal annealing at high temperature, and the details will be discussed in Section 5. Because graphene is usually used in the form of thin films, like TCF, Rs-f by a four-probe method on the surface of a macroscopic film is often used to describe its electrical conductivity when prepared using different ways. The lowest Rs-f (0.84 kX/sq) of rGO-based TCF (10 nm in thickness) was achieved by Zhao et al. by chemical Copyright 2008 Elsevier. 2008 CARBON Fig. 4 – The C1s XPS spectra of (a) GO and (b) rGO [56]. 3214 CARBON 5 0 ( 2 0 1 2 ) 3 2 1 0 –3 2 2 8 Table 1 – Comparison of the reducing effect of GO by different methods. Ref. no. [56] [69] [70] [71] [55] [72] [42] [73] [58] a b Reduction method Form C/O ratio r (S/cm) Hydrazine hydrate Hydrazine reduction in colloid state 150 mM NaBH4 solution, 2 h Hydrazine vapor Thermal annealing at 900 C, UHVa Thermal annealing at 1100 C, UHV Thermal annealing at 1100 C in Ar/H2 Multi-step treatment: (I) NaBH4 solution (II) Concentrated H2SO4 180 C, 12 h (III) Thermal annealing at 1100 C in Ar/H2 Vitamin C Hydrazine monohydrate Pyrogallol KOH 55% HI reduction Powder Film TCF Film 10.3 NAb 8.6 8.8 14.1 NA NA (I) 4.78 (II) 8.57 (III) >246 2 72 0.045 NG NG 103 727 (I) 0.823 (II) 16.6 (III) 202 12.5 12.5 NA NA >14.9 77 99.6 4.8 1.9103 298 TCF TCF Powder Film Film UHV: ultra high vacuum. NA: not available. In addition to the three parameters presented above, some other analysis techniques, such as Raman spectroscopy, solid-state FT-NMR spectroscopy, transmission electron microscopy (TEM), and atomic force microscopy (AFM), are also used to show the structure and property changes of GO after reduction. These analyses can give more detailed information on the structure of GO and rGO, and be helpful to understand the mechanisms of reduction processes, but in most cases, these results are not as clear in showing the reducing effect as are the three parameters mentioned earlier. 4. Reduction strategies 4.1. Thermal reduction 4.1.1. Thermal annealing GO can be reduced solely by heat treatment and the process is named thermal annealing reduction. In the initial stages of graphene research, rapid heating (>2000 C/min) was usually used to exfoliate graphite oxide to achieve graphene [35,45,74,75]. The mechanism of exfoliation is mainly the sudden expansion of CO or CO2 gases evolved into the spaces between graphene sheets during rapid heating of the graphite oxide. The rapid temperature increase makes the oxygencontaining functional groups attached on carbon plane decompose into gases that create huge pressure between the stacked layers. Based on state equation, a pressure of 40 MPa is generated at 300 C, while 130 MPa is generated at 1000 C [74]. Evaluation of the Hamaker constant predicts that a pressure of only 2.5 MPa is enough to separate two stacked GO platelets [74]. The exfoliated sheets can be directly named graphene (or chemically derived graphene) rather than GO, which means that the rapid heating process not only exfoliates graphite oxide but also reduces the functionalized graphene sheets by decomposing oxygen-containing groups at elevated temperature. This dual-effect makes thermal expansion of graphite oxide a good strategy to produce bulk quantity graphene. However, this procedure is found only to produce small size and wrinkled graphene sheets [45]. This is mainly because the decomposition of oxygen-containing groups also removes carbon atoms from the carbon plane, which splits the graphene sheets into small pieces and results in the distortion of the carbon plane, as shown in Fig. 5. A notable effect of thermal exfoliation is the structural damage to graphene sheets caused by the release of carbon dioxide [49]. Approximately 30% of the mass of the graphite oxide is lost during the exfoliation process, leaving behind lattice defects throughout the sheet [45]. Defects inevitably affect the electronic properties of the product by decreasing the ballistic transport path length and introducing scattering centers. As a result, the electrical conductivity of the graphene sheets has a typical mean value of 10–23 S/cm that is much lower than that of perfect graphene, indicating a weak effect on reduction and restoration of the electronic structure of carbon plane. An alternative way is to exfoliate graphite oxide in the liquid phase, which enables the exfoliation of graphene sheets with large lateral sizes [34]. The reduction is carried out after the formation of macroscopic materials, e.g. films or powders, by annealing in inert or reducing atmospheres. In this strategy, the heating temperature significantly affects the effect of reduction on GO [45,55,66,71,72,76]. Schniepp et al. [45] found that if the temperature was less than 500 C, the C/O ratio was no more than 7, while if the temperature reached 750 C, the C/O ratio could be higher than 13. Li et al. have monitored the chemical structure variation with annealing temperature, and the XPS spectrum evolution shown in Fig. 6 reveals that high temperature is needed to achieve the good reduction of GO. Wang et al. [72] annealed GO thin films at different temperatures, and showed that the volume electrical conductivity of the reduced GO film obtained at 500 C was only 50 S/cm, while for those at 700 C and 1100 C it could be 100 S/cm and 550 S/cm (Fig. 7), respectively. Wu et al. [76] used arc-discharge treatment to exfoliate graphite oxide to prepare graphene. Since the arc-discharge could provide temperatures above 2000 C in a short time, 5 0 ( 20 1 2 ) 3 2 1 0–32 2 8 3215 Copyright 2006 ACS. 2006 CARBON Copyright 2009 ACS. 2009 Fig. 5 – Pseudo-3D representation of a 600 nm · 600 nm AFM scan of an individual graphene sheet showing the wrinkled and rough structure of the surface, and an atomistic model of the graphite oxide to graphene transition [45]. Copyright 2008 ACS. 2008 Fig. 6 – XPS spectra of GO sheets annealed in 2 Torr of (a) NH3/Ar (10% NH3) and (b) H2 at various temperatures [77]. Fig. 7 – Increase of the average conductivity of graphene films from 49, 93, 383 to 550 S/cm, along with the temperature increasing from 550 C, 700 C, 900 C to 1100 C, respectively [72]. the typical sheet electrical conductivity of graphene sheets was about 2000 S/cm, and elemental analysis revealed that the exfoliated graphene sheets had a C/O ratio of 15–18. In addition to annealing temperature, annealing atmosphere is important for the thermal annealing reduction of GO. Since the etching of oxygen will be dramatically increased at high temperatures, oxygen gas should be excluded during annealing. As a result, annealing reduction is usually carried out in vacuum [55], or an inert [72] or reducing atmosphere [35,72,75,77]. Becerril et al. [55] have reduced GO films by thermal annealing at 1000 C, and found that a quality vacuum (<105 Torr) is key for the recovery of GO, otherwise the films can be quickly lost through reaction with residual oxygen in the system. The same condition should also be considered in inert atmospheres. Therefore, a reducing gas such as H2 is added to consume the residual oxygen in the atmosphere. Furthermore, because of the high reducing ability of hydrogen at elevated temperatures, the reduction of GO can be realized at a relatively low temperature in a H2 atmosphere. Wu et al. reported that GO can be well reduced at 450 C for 2 h in an Ar/H2 (1:1) mixture with a resulting C/O ratio of 14.9 and conductivity of 1 · 103 S/cm. Li et al. [77] reported that annealing GO in low-pressure ammonia (2 Torr NH3/Ar (10% NH3)) can produce simultaneous nitrogen doping and reduction of GO. 3216 CARBON 5 0 ( 2 0 1 2 ) 3 2 1 0 –3 2 2 8 As shown in Fig. 6, the highest doping level of 5% N is obtained at 500 C, and electrical measurements of GO sheets demonstrate that GO annealed in NH3 exhibits a higher conductivity than that annealed in H2 and clearly shows n-type electron doping behavior. The latter may be beneficial for the fabrication of electronic devices. Recently, Lopez et al. [62] demonstrated that vacancies can be ‘‘repaired’’ partially by exposing rGO to a carbon source such as ethylene at a high temperature (800 C), similar to the conditions used for CVD growth of SWCNTs. With this post-reduction deposition of carbon, the sheet resistance of individual rGO sheet can be decreased to 28.6 kX/sq (or 350 S/cm) [78]. Su et al. reported a similar defect healing effect for rGO sheets functionalized with aromatic molecules during pyrolysis that results in a highly graphitic material with a conductivity as high as 1314 S/cm [63]. Based on the above results, reduction of GO by high temperature annealing is highly effective. But the drawback of thermal annealing is also obvious. First, high temperature means large energy consumption and critical treatment conditions. Second, if the reduction is performed to an assembled GO structure, e.g. a GO film, heating must be slow enough to prevent the expansion of the structure, otherwise quick heating may explode the structure just like the exfoliation of graphite oxide. But slow heating makes the thermal reduction of GO a time-consuming process. Finally and importantly, some applications need to assemble GO on substrates, e.g. thin carbon films, but the high temperature means that this reduction method cannot be used for GO films on substrates with a low melting-point, such as glass and polymers. Flash reduction [81] of free-standing GO films can be done with a single, close-up (<1 cm) flash from a xenon lamp such as exists on a camera. The photo energy emitted by the flash lamp at a close distance (<2 mm: 1 J/cm2) can provide 9 times the thermal energy needed for heating GO (thickness 1 lm) over 100 C, which should be more than enough to induce deoxygenating reactions, and suggests that flash irradiation could lead to a much higher degree of reduction of GO. The GO films typically expand tens of times after flash reduction because of rapid degassing, and the electrical conductivity of the expanded film is around 10 S/cm using its maximum expanded thickness in the calculation. Because the light can be easily shielded, rGO patterns can be easily fabricated with photomasks, which facilitates the direct fabrication of electronic devices based on rGO films, as shown in Fig. 8a. A further improvement of the photo-reduction and patterned film fabrication was carried out with femtosecond laser irradiation as proposed by Zhang et al. [82] The focused laser beam (laser pulse of 790 nm central wavelength, 120 fs pulse width, 80 MHz repetition rate, focused by a ·100 objective lens) has even higher power density than a xenon lamp flash and the heated area in a GO film is very localized with a line width in the range of 101–101 lm. As a result, the laser reduction can produce rGO films with a much higher conductivity of 256 S/cm, and the rGO film patterns can be drawn directly by a pre-programmed laser on the GO film to form more complicated and delicate circuits as shown in Fig. 8b–e. 4.1.2. Reduction by chemical reagents is based on their chemical reactions with GO. Usually, the reduction can be realized at room temperature or by moderate heating. As a result, the requirement for equipment and environment is not as critical as that of thermal annealing treatment, which makes chemical reduction a cheaper and easily available way for the mass production of graphene compared with thermal reduction. The reduction of graphite oxide by hydrazine was used before the discovery of graphene [83], while the use of hydrazine to prepare chemically derived graphene was first reported by Stankovich et al. [56,84]. These reports open an easy way for Microwave and photo reduction Thermal annealing is usually carried out by thermal irradiation. As an alternative, some unconventional heating resources have been tried to realize thermal reduction including microwave irradiation (MWI) [79,80] and photo-irradiation [81,82]. The main advantage of MWI over conventional heating methods is heating substances uniformly and rapidly. By treating graphite oxide powders in a commercial microwave oven, rGO can be readily obtained within 1 min in ambient conditions [79]. 4.2. Chemical reduction 4.2.1. Chemical reagent reduction Fig. 8 – Patterned rGO film obtained by (a) flash reduction [81] (Copyright 2009 ACS) and (b–e) femtosecond laser reduction [82]. Scale bars, 10 lm (Copyright 2009 Elsevier). The black parts in the films are the reduced GO patterns. CARBON 5 0 ( 20 1 2 ) 3 2 1 0–32 2 8 an additional dehydration process using concentrated sulfuric acid (98% H2SO4) at 180 C after reduction by NaBH4 to further improve the reduction effect on GO. The C/O ratio of rGO by the two-step treatment is about 8.6 and the conductivity of the rGO powder produced is about 16.6 S/cm. Ascorbic acid (Vitamin C: VC) is a newly reported reducing reagent for GO, which is considered to be an ideal substitute for hydrazine [73]. Fernandez-Merino et al. revealed that GO reduced by VC could achieve a C/O ratio of about 12.5 and a conductivity of 77 S/cm, which are comparable to those produced by hydrazine in a parallel experiment. In addition, VC has great advantage of its non-toxicity in contrast to hydrazine and a higher chemical stability with water than NaBH4. Furthermore, the reduction in colloid state does not result in the aggregation of rGO sheets as produced by hydrazine, which is beneficial for further applications. Recently, Pei et al. [58] and Moon et al. [97] reported another strong reducing reagent, hydroiodic acid (HI), for GO. The two independent investigations report similar reduction results in that the C/O ratio of rGO is around 15, and the conductivity of the rGO films is around 300 S/cm, both of which are much better than obtained by other chemical reduction methods. The reduction by HI can be realized using GO in the form of a colloid, powder or film in a gas or solution environment, even at room temperature [97]. The comparison of the reduction effects on GO films with HI, hydrazine vapor, 85% hydrazine hydrate and NaBH4 solution are shown in Fig. 9. The GO film reduced by HI has good flexibility and even improved tensile strength, while the hydrazine vapor-reduced GO film becomes too rigid to be rolled and the film thickness expanded more than 10 times. Contrarily, the GO films re- Copyright 2010 Elsevier. 2010 the mass-production of graphene. As a result, hydrazine has been accepted as a good chemical reagent to reduce GO [51,66,69,73,84–94]. The reduction by hydrazine and its derivatives, e.g. hydrazine hydrate and dimethylhydrazine [95], can be achieved by adding the liquid reagents to a GO aqueous dispersion, which results in agglomerated graphene-based nanosheets due to the increase of hydrophobility. When dried, an electrically conductive black powder with C/O ratio around 10 [56] can be obtained. The highest conductivity of rGO films produced solely by hydrazine reduction is 99.6 S/ cm combined with a C/O ratio of around 12.5 [73]. To facilitate the application of graphene, efforts have been made to reduce GO while retaining the colloidal state in water by adding soluble polymers [84] as surfactant, or ammonia [69] to change the charge state of rGO sheets. The graphene sheets suspended in colloidal solutions can be used to assemble macroscopic structures by simple solution processes like filtration [69]. Metal hydrides, e.g. sodium hydride, sodium borohydride (NaBH4) and lithium aluminium hydride, have been accepted as strong reducing reagents in organic chemistry, but unfortunately, these reductants have a slight to very strong reactivity with water, which is the main solvent for the exfoliation and dispersion of GO. Recently, NaBH4 was demonstrated more effective than hydrazine as a reductant of GO [70]. Although it is also slowly hydrolyzed by water, its use is kinetically slow enough that the freshly-formed solution functions effectively to reduce GO. Since NaBH4 is most effective at reducing C = O species but has low to moderate efficiency in the reduction of epoxy groups and carboxylic acids [96], alcohol groups remain after reduction. As an improvement, Gao et al. [42] proposed 3217 Fig. 9 – Optical photographs of GO films (a) before and (b–d) after chemical reduction by different agents: (b) HI, (c) hydrazine vapor, (d) 85% N2H4ÆH2O (N2H4), 50 mM NaBH4 solution (NaBH4) and 55% HI after immersion for 16 h at room temperature, (e) the stress–strain curve of the GO film and HI reduced GO film (r = stress, e = strain), and SEM images of the cross-section views of GO films (f) before and (g, h) after reduction by (g) HI and (h) hydrazine vapor [58]. 3218 CARBON 5 0 ( 2 0 1 2 ) 3 2 1 0 –3 2 2 8 duced by N2H4ÆH2O and NaBH4 solutions broke up into pieces. These results show that HI not only has a better reducing effect than hydrazine, but is also suitable for the reduction of GO films. As a result, reduction by HI can be used to reduce GO thin films to high-performance TCFs [34,58]. Other reductants including hydroquinone [98], pyrogallol [73], hot strong alkaline solutions (KOH, NaOH) [99], hydroxylamine [100], urea and thiourea have been used. However, these reagents tend to be inferior to strong reductants, such as hydrazine, NaBH4, and HI, based on the reported results. 4.2.2. Photocatalyst reduction Copyright 2008 ACS. 2008 Different from the photothermal reduction described above, GO can also be reduced by photo-chemical reactions with the assistance of a photocatalyst like TiO2. Recently, Williams et al. reported the reduction of GO in a colloid state with the assistance of TiO2 particles under ultraviolet (UV) irradiation. As shown in Fig. 10, a change in color from light brown to dark brown to black can be seen as the reduction of GO proceeds [101]. This color change has previously been suggested as partial restoration of the conjugated network in the carbon plane like that in chemical reduction processes. The photocatalytic properties of semiconducting TiO2 particles have been thoroughly investigated [102]. According to the formula shown in Fig. 10, upon UV-irradiation, charge separation occurs on the surface of TiO2 particles. In the presence of ethanol the holes are scavenged to produce ethoxy radicals, thus leaving the electrons to accumulate within the TiO2 particles. The accumulated electrons interact with GO sheets to reduce functional groups. The same reduction effect has also been found in other carbon nanostructures such as fullerene and carbon nanotubes [103,104]. Before reduction, the carboxyl groups in GO sheets can interact with the hydroxyl groups on the TiO2 surface by charge transfer, producing a hybrid between the TiO2 nanoparticles and the GO sheets, and this structure can be retained after reduction. The rGO sheets can work as a current collector to facilitate the separation of electron/hole pairs in some photovoltaic devices like a photocatalysis device [105] and a dye-sensitized solar cell [106,107]. Following the same idea, some other materials with photocatalytic activity, like ZnO [108] and BiVO4 [109], have also been reported to achieve the reduction of GO. Fig. 10 – Color change of a 10 mM solution of TiO2 nanoparticles with 0.5 mg/mL GO before and after UV irradiation for 2 h in ethanol. A suspension of 10 mM TiO2 nanoparticles is also shown for comparison [101]. 4.2.3. Electrochemical reduction Another method that shows promise for the reduction of GO relies on the electrochemical removal of oxygen functionalities [110–113]. Electrochemical reduction of GO sheets or films can be carried out in a normal electrochemical cell using an aqueous buffer solution at room temperature. The reduction usually needs no special chemical agent, and is mainly caused by the electron exchange between GO and electrodes. As a merit, this could avoid the use of dangerous reductants (e.g. hydrazine) and eliminate byproducts. After depositing a thin film of GO on a substrate (glass, plastic, ITO, etc.), an inert electrode is placed opposite the film in an electrochemical cell and reducing occurs during charging of the cell. By cyclic voltammetric scanning in the range of 0 to 0.1 V (respect to a saturated calomel electrode) to a GO-modified electrode in a 0.1 M KNO3 solution, Ramesha and Sampath [113] found that the reduction of GO began at 0.6 V and reached a maximum at 0.87 V. The reduction can be achieved by only one scan and is an electrochemically irreversible process in this scanning voltage range. Zhou et al. [110] reported the best reduction effect using an electrochemical method. Elemental analysis of the resultant rGO revealed a C/O ratio of 23.9, and the conductivity of the rGO film produced was measured to be approximately 85 S/ cm. They found that the potential needed to realize the reduction is controlled by the pH value of the buffer solution. A low pH value is favorable to the reduction of GO, so the authors proposed that H+ ions participate in the reaction. An et al. [112] used electrophoretic deposition (EPD) to make GO films. They found that GO sheets can also be reduced on the anode surface during EPD, which seems counter-intuitive to the general belief that oxidation occurs at the anode in an electrolysis cell. Though the reduction mechanism is not clear, the simultaneous film assembly and reduction might be favorable to some electrochemical applications. 4.2.4. Solvothermal reduction Another emerging chemical reduction method is solvothermal reduction [59,114,115]. A solvothermal process is performed in a sealed container, so that the solvent can be brought to a temperature well above its boiling point by the increase of pressure resulting from heating [116]. In a hydrothermal process, overheated supercritical (SC) water can play the role of reducing agent and offers a green chemistry alternative to organic solvents. In addition, its physiochemical properties can be widely changed with changes in pressure and temperature, which allows the catalysis of a variety of heterolytic (ionic) bond cleavage reactions in water. Hydrothermal routes have been used for remarkable transformation of carbohydrate molecules to form homogeneous carbon nanospheres [117,118] and nanotubes [119]. Zhou et al. [59] proposed a ‘‘water-only’’ route by hydrothermal treatment of GO solutions. The results show that the SC water not only partly removes the functional groups on GO, but also recovers the aromatic structures in the carbon lattice. The investigation of the pH dependence of the hydrothermal reaction found that a basic solution (pH = 11) yields a stable rGO solution while an acidic solution (pH = 3) results in aggregation of rGO sheets, which cannot be re-dispersed even in a concentrated ammonia solution. This reduction process CARBON 5 0 ( 20 1 2 ) 3 2 1 0–32 2 8 is believed to be analogous to the H+-catalyzed dehydration of alcohol, where water acts as a source of H+ for the protonation of hydroxyl groups. Wang et al. [114] reported the reduction of GO by solvothermal reduction using N,N-dimethylformamide as the solvent. This is different from the hydrothermal reduction in that a small amount of hydrazine was added as the reduction agent. After solvothermal treatment at 180 C for 12 h, the C/O ratio of rGO (detected by Auger spectroscopy) reached 14.3, which is much higher than that produced by hydrazine reduction at normal pressure. However, the sheet resistance of the rGO is in the range of 105–106 X/sq, and the poor conductivity may result from nitrogen-doping caused by the hydrazine reduction. Dubin et al. [115] proposed a modified solvothermal reduction method using N-methyl-2-purrolidinone (NMP) as solvent. This treatment is different from the traditional way in that the reduction is not performed in a sealed container and the heating temperature (200 C) is lower than the boiling point of NMP (202 C, 1 atm). As a result, there is no additional pressure present in the reduction process. The deoxygenation of GO was proposed to be realized in combination with the moderate thermal annealing and the oxygen-scavenging properties of NMP at high temperature. The electrical conductivity of the rGO films achieved by this solvothermal reduction and subsequent vacuum filtration is 3.74 S/cm, which is one order of magnitude smaller than that produced by hydrazine reduction (82.8 S/cm). The C/O ratio of the solvothermal reduced GO is only 5.15, much lower than the other results shown above. Therefore, this moderate temperature NMPonly solvothermal reduction method can only achieve a moderate reduction of GO. Besides the above features of each method, these solvothermal reduction methods have the common merit that all can produce a stable dispersion of rGO sheets, which is valuable for applications. 4.3. Multi-step reduction The reduction strategies introduced above are mostly realized in one step. To further improve or optimize the reduction effect for some special purposes, multi-step reduction has been proposed [42,88,120,121]. For example, Eda et al. [121] found that pre-reduction by hydrazine vapor could effectively decrease the annealing temperature needed to obtain the good reduction of a GO film. The combination of hydrazine reduction and low temperature thermal annealing at 200 C could produce an rGO film with better conductivity than that produced by only thermal annealing at 550 C, which is important for flexible devices attached to polymer substrates. In most chemical reactions, the effect of reagents is selective. As a result, one reducing reagent usually cannot eliminate all oxygen-containing functional groups. On the basis of the chemical composition of GO, multi-step reduction is proposed to be much effective. Gao et al. [42] proposed a three-step reduction process: deoxygenation with NaBH4, dehydration with concentrated sulfuric acid and thermal annealing. The treatment by NaBH4 can eliminate ketone, lactol, ester and most alcohol groups. Treatment in concentrated H2SO4 at 180 C can then dehydrate the remaining alcohol 3219 groups to form alkene bonds that are part of a conjugated sp2 carbon network. Subsequent annealing in Ar/H2 at 1100 C for 15 min reduces the oxygen content to less than 0.5 wt.%, which is close to the value in graphite powder. This treatment gives rGO with a C/O ratio higher than 246, which is the highest value reported until now, but the electrical conductivity of the rGO film is only 202 S/cm, much lower than that achieved by direct annealing in an Ar atmosphere at the same temperature reported by Wang et al. [72]. 5. Reduction mechanism Though numerous strategies have been proposed to reduce GO, there are still many questions without clear answers. For example, can the functional groups of a GO sheet be fully eliminated? Can the lattice defects formed during oxidation be restored during reduction? Does a reduction process decrease or increase the defect density in a graphene sheet? The answers and further improvements in GO reduction will rely on an improved understanding of reduction mechanisms. But only limited work has focused on the reduction mechanisms of GO, which may be caused by the amorphous nature of rGO, the complexity of chemical reactions and the lack of means to directly monitor reduction processes. As a result, most of the research was performed fully or mostly through computer simulation at a molecular level. As proposed in Section 2, the difference in structure of GO and graphene lies in a large amount of chemical functional groups attached to the carbon plane and structural defects within the plane, both of which can severely decrease the electrical conductivity. As a result, the reduction of GO can be considered to be aimed at achieving two targets: the elimination of functional groups and the healing of structural defects. For the elimination of functional groups, there are also two effects that should be considered: whether the oxygencontaining groups can be removed and whether the areas after removal can be restored to a long-range conjugated structure, so that there are pathways for carrier transport within the rGO sheet. For the healing of structural defects, there are two possibilities, graphitization at high temperature and epitaxial growth or CVD in the defective area with an extra carbon supply. 5.1. Elimination of functional groups The conductivity of monolayer graphene mainly relies on carrier transport within the carbon plane, as a result, functional groups attached to the plane are the main influencing factor on its conductivity, while functional groups attached to the edge have less influence. Consequently, the reduction of GO must be mainly aimed at eliminating epoxy and hydroxyl groups on the plane, while other groups, e.g. carboxyl, carbonyl and ester groups, present at the edges or defective areas only have a limited influence on the conductivity of an rGO sheet. As proof, Li et al. [69] reduced GO using hydrazine in a solvent, and the carboxyl groups attached to the GO are preserved after reduction. This can be used to disperse rGO sheets in a basic solution but has little influence on the conductivity of rGO sheets and assembled films. 3220 5.1.1. CARBON 5 0 ( 2 0 1 2 ) 3 2 1 0 –3 2 2 8 Thermal deoxygenation Copyright 2009 ACS. 2009 Though reduction methods are different from each other, the nature of deoxygenation is common for the removal of oxygen-containing groups from the graphene. The binding energy (or dissociation energy) between graphene and different oxygen-containing functional groups can be an important index to evaluate the reducibility of each group attached to the carbon plane, especially during the thermal deoxygenation processes. By using density functional theory (DFT) calculation, Kim et al. [122] obtained the binding energy of an epoxy group (62 kcal/mol) and a hydroxyl group (15.4 kcal/mol) to a 32-carbon-atom graphene unit, which indicates that epoxy groups are much more stable than hydroxyl groups in GO. In a calculation by Gao et al. [123], the epoxy and hydroxyl groups in GO are divided into two types for their different locations at the interior of an aromatic domain of GO (A, B) and at the edge of an aromatic domain (A 0 , B 0 ), as shown in Fig. 11. Because of the low binding energy, a single hydroxyl group attached to the interior aromatic domain is not stable and is subject to dissociation at room temperature, while a hydroxyl group attached to the edge is stable at room temperature. As a result, hydroxyl groups attached to the inner aromatic domains Fig. 11 – Schematic of oxygen-containing groups in GO: A, epoxy groups located at the interior of an aromatic domain of GO; A 0 , epoxy groups located at the edge of an aromatic domain; B, hydroxyl located at the interior of an aromatic domain; B 0 , hydroxyl at the edge of an aromatic domain; C, carbonyl at the edge of an aromatic domain; and D, carboxyl at the edge of an aromatic domain [123]. of GO are expected to dissociate or migrate to the edges of aromatic domains. An increase in temperature can facilitate the thermal deoxygenation of GO. According to Gao’s calculations, the critical dissociation temperature (Tc) of hydroxyl groups attached to the edges of GO is 650 C, and only above this temperature can hydroxyl groups be fully removed. For dehydroxylation, a hydroxyl group is believed to more favorably leave the graphene sheet directly, producing an OH radical and a graphene radical [123,124], which does not result in the formation of a lattice defect within the plane. There is no exact Tc for epoxy groups given in Gao’s paper [123], but, as shown in Table 2, after thermal annealing at temperatures of 700–1200 C in vacuum, the hydroxyl groups can be fully eliminated, while the epoxy groups are retained. In comparison, carboxyl groups are expected to be slowly reduced at 100–150 C, while carbonyl groups are much more stable, and can only be removed above a Tc as high as 1730 C. According to these simulations, many functional groups are hard to remove even after thermal annealing above 1000 C, while in some experimental work, the deoxygenation processes are not as difficult as predicted. Jeong et al. [125] has investigated the thermal stability of graphite oxide. According to their results, most of the oxygen-containing groups can be removed by annealing at 200 C in low-pressure argon (550 mTorr). After annealing for 6 h, according to the results of Fourier-transformed infrared spectroscopy (FTIR), the peaks representing epoxy and carboxyl groups obviously decrease, and the peak for hydroxyl groups totally disappears. These phenomena become even more pronounced after annealing for 10 h, and the reduced graphite oxide can have a C/O ratio of 10. Yang et al. [71] and Mattevi et al. [66] evaluated the chemical structure change of GO films on substrates by thermal annealing at different temperatures as well as atmospheres. Annealing at certain temperatures takes a relatively short time (15 min or 30 min) compared with Jeong’s work. The increase of annealing temperature shows obvious improvement in the deoxygenation of GO. In Yang’s work, the highest temperature used was only 1000 C, and the highest C/O ratio achieved is around 14 after annealing at 900 C in ultra high vacuum for 15 min. The good reduction effect by thermal annealing at around 1000 C was also proved by the high conductivity reported by Becerril et al. [55] and Wang et al. [72]. The results of theoretical simulations and experiments do not seem to agree with each other. One difference that should be noted is that the simulations are usually carried out using Table 2 – Status of oxygen-containing functional groups upon treatment with hydrazine and thermal annealing [123]. Copyright 2009 ACS. Groups in Fig. 11 A A0 B B0 C D Hydrazine reduction in room temperature Removed Converted to hydrazino alcohol Removed Not removed Not removed Partly removed Thermal annealing at 700–1200 C Not removed Not removed Removed Removed Not removed Removed Hydrazine reduction plus thermal annealing Removed Not removed Removed Removed Not removed Removed CARBON a model with a low functional group density on a graphene, but the functional groups in a real GO sheet are more crowded according to the low C/O ratio (2:1–4:1) detected by elemental analysis. Boukhvalov and Katsnelson [126] have calculated the chemisorption energy of oxygen atoms (epoxy groups) and hydroxyl groups on graphene with different coverages. Their results indicate that the interaction among adjacent groups and the lattice distortion caused by the attaching of functional groups with high coverage to the carbon plane can make desorption of them much easier. As a result, a reduction of GO from 75% to 6.25% (C/O ratio 16:1) coverage is relatively easy, but further reduction seems to be more difficult. Recently, Bagri et al. [127] used molecular dynamics (MD) simulations to study the atomistic structure of progressively reduced GO. Their results confirm that hydroxyl groups desorb at low temperatures without altering the graphene plane. Isolated epoxy groups are more stable, but substantially distort the graphene lattice on desorption. The removal of carbon from the graphene is more likely to occur when the initial hydroxyl and epoxy groups are in close proximity to each other. The reaction pathway between two nearby functional groups during thermal annealing leads to the formation of carbonyl and ether groups, which are thermodynamically very stable. The chemical changes of oxygencontaining functional groups on the annealing of GO were elucidated and the simulations reveal the formation of highly stable carbonyl and ether groups that hinder its complete reduction to graphene. As a result, as the experimental work has discovered, a large number of functional groups can be removed by moderate heating above 200 C with enough time, but the full deoxygenation of GO solely by thermal annealing is rather difficult even at temperatures as high as 1200 C. the formation of an aminoaziridine moiety which then undergoes thermal elimination of di-imide to form a double bond [128,129], resulting in the re-establishment of the conjugated graphene network. Kim et al. [122] considered the epoxide reduction with hydrazine on a graphene monolayer using DFT calculations. Their results proved that the reduction reaction is mainly governed by epoxide ring opening which is initiated by hydrogen transfer from hydrazine, and the formation of derivatives such as NHNH2 during the reduction can facilitate the deepoxidation by lowering the barrier height of the ring-opening reaction. Gao et al. [123] further elucidated the effect of hydrazine treatment on different functional groups by DFT simulation. Their results show that the hydrazine reduction can only result in reducing epoxy groups, while no reaction path was found for the reduction of the hydroxyl, carbonyl and carboxyl groups of GO. They designed several reduction routes for de-epoxidation by hydrazine, and all the routes start from the ring-opening of epoxy groups and form hydroxyl groups on the original sites. According to their calculations (as shown in former section), hydroxyl groups attached within an aromatic domain are not stable even at moderate temperatures, and can be removed or migrate to the edges of aromatic domains and restore the conjugated structure after dehydroxylation. As a result, a much simple reduction pathway can be expected, in which the reduction of GO is simply the combination of a ring-opening of epoxy groups to form hydroxyl groups and dehydroxylation by moderate heat treatment. After this process, the carbon plane of GO can be as clean as that of pure graphene. This proposal is supported by the reduction of GO by hot alkaline solutions [99] and hydrohalic acids [58,97] since the ring-opening reactions can be catalyzed by both alkalis and acids [130]. Chemical deoxygenation As is true for thermal reduction, chemical reduction can also not fully remove the functional groups in GO since the highest C/O ratio reported is no more than 15 [58]. One important feature of the chemical reduction of GO is that the deoxygenation can happen at low or moderate temperatures with the help of reducing reagents. Since chemical reduction processes rely on chemical reactions, the chemical deoxygenation may be selective to certain groups depending on the reducing reagent. But because of the complexity of chemical reactions, the mechanisms of the chemical reduction of GO are mostly proposed, and only a few papers have dealt with the reduction by hydrazine using molecular simulations. The reduction mechanism by hydrazine was firstly proposed by Stankovich et al. [56] as shown in Fig. 12. This reduction process starts from the ring-opening of epoxy groups by hydrazine to form hydrazino alcohols, and the initial derivative produced by the epoxide opening reacts further with 5.1.3. Restoration of long-range conjugated structures A final target of GO reduction is to achieve as high an electrical conductivity as that of graphene. In ideal graphene, electrons can transport without scattering within a graphene sheet with a lateral size more than sub-micrometers. This is called the long-range ballistic transport of graphene, which relies on its perfect long-range conjugated structure. After oxidation, this perfect structure is destroyed by functional groups and defects, so the recovery of conductivity depends on the restoration of the long-range conjugated structure. Mattevi et al. [66] proposed a structure evolution of GO during thermal annealing as shown in Fig. 13a–d. Initially, the sp2 clusters in GO are isolated by functionalized and defective areas (indicated by light gray dots). As the material is progressively reduced, interactions (hopping and tunneling) among the clusters increase (Fig. 13b). Further reduction by the removal of oxygen leads to greater connectivity among the ori- Fig. 12 – Proposed reaction pathway for epoxide reduction with hydrazine [56]. Copyr ight 2007 Elsevier. 5.1.2. 3221 5 0 ( 20 1 2 ) 3 2 1 0–32 2 8 CARBON 5 0 ( 2 0 1 2 ) 3 2 1 0 –3 2 2 8 Copyright 2011 NPG. 2011 3222 Fig. 13 – (a–d) Structural model of GO at different stages of reduction by thermal annealing [66]. (a) Room temperature, (b) 100 C, (c) 220 C, (d) 500 C. The dark grey areas represent sp2 carbon clusters and the light grey areas represent sp3 carbon bonded to oxygen groups (represented by small dots). At 220 C, percolation among the sp2 clusters is initiated (corresponding to sp2 fraction of 0.6). Copyright 2009 Wiley-VCH. (e–j) Simulated morphology of (e, h) GO and (f, g, i, j) rGO sheets with an initial oxygen concentration of 20% (e–g) and 33% (h–j) in the form of hydroxyl and epoxy groups in the ratio of 3/2 after annealing at 1500 K in (f, i) vacuum and (g, j) H2 atmosphere [127]. ginal graphitic domains by the formation of new sp2 clusters. This phenomenon is the restoration of the long-range conjugated structure of GO. According to their results, if the amount of sp2 structure reaches 60%, the conductivity of GO meets a threshold of percolation, which is in agreement with theoretical threshold values for conduction in two dimensional disks [131]. Boukhvalov et al. [126] also predicted that GO becomes conducting at 25% coverage by functional groups. That is, if a reduction process can make the C/O ratio of GO more than 4, an insulating GO sheet can become conductive even though the conductivity is low. The improvement of conductivity relies on the presence of more conductive pathways in carbon plane, but not all reduction methods can restore these pathways. Bagri et al. [127] studied the atomistic structure change of progressively reduced GO using molecular dynamics (MD) simulations, as shown in Fig. 13e, f, h and i, GO sheets with different oxygen concentrations (oxygen present in the form of hydroxyl and epoxy groups in the ratio of 3/2) become more defective and disordered after thermal annealing at 1500 K. In comparison, GO with a higher initial oxygen-content is more defective (Fig. 13f and i), and an increase in the number of vacancy defects results from the desorption of epoxy groups by forming CO2 and CO gases. The disordered lattice structure is caused by the re-arrangement of carbon atoms to release the stress caused by new defects. More efficient reduction along with healing of rGO was proposed by annealing in the presence of hydrogen [127]. The structures of rGO with different concentrations of oxygen atoms annealed in a hydrogen atmosphere are shown in Fig. 13g and j. Three mechanisms are proposed for the increase in reduction using hydrogen. The first is the evolution of residual carbonyl pairs through the formation of water molecules and hydroxyl groups and re-arrangement of the carbon atoms in the graphene sp2 configuration, which leads to the healing of holes formed by a carbonyl pair. The second is the formation of hydroxyl groups with residual ether and epoxy groups in the presence of a hydrogen atmosphere and the subsequent evolution of the hydroxyl functional groups by thermal annealing without introducing additional defects. Finally, residual hydroxyl groups are released from the carbon plane by the formation of water molecules. The participation of hydrogen atoms makes deoxygenation become a series of chemical reactions with a relatively low energy barrier compared with the direct rupture of the C–O bond, which usually needs more energy than that of breaking C–C bonds in graphene [58]. Consequently, the reduction of GO by chemical reactions has the advantage of maintaining the structure of the carbon plane, and thermal annealing at high temperature can facilitate the desorption of various functional groups. As a result, a combination of chemical reactions and thermal annealing is more efficient for deoxygenation compared with any one-step processes by thermal or chemical reduction alone. Experimentally, an astonishingly high C/O ratio of 246 and a relatively high conductivity were obtained by a designed multistep reduction by Gao et al. [42]. CARBON 5.2. 5 0 ( 20 1 2 ) 3 2 1 0–32 2 8 Healing of defects sequential exposure of GO to CO and NO molecules, but no experimental result is given to prove this prediction. Dai et al. [135] presented a strategy for the real-time repair of the newborn vacancies with carbon radicals produced by the thermal decomposition of precursors. The sheet conductivity of the monolayer graphene obtained was raised more than sixfold to 350–410 S/cm with a transparency more than 96%. Except for the improved conductivity, a very common phenomenon in these reported results is the increase of the intensity ratio of the D and G bands (ID/IG) in Raman spectra after the reduction. Lopez et al. [62] even found that the CVD-GO exhibits an approximately linear rise of electrical conductivity with increasing ID/IG. Usually, ID/IG is a measure of disordered carbon, as expressed by the sp3/sp2 carbon ratio [136] and an increase of ID/IG means the degradation of crystallinity of graphitic materials. The increase of ID/IG is usually explained as a decrease in the average size but an increase in the number of sp2 domains upon reduction [137], but this effect obviously cannot be considered as the healing or repairing of defects in GO. Lucchese et al. [138] studied the evolution of the Raman spectrum of monolayer graphene by consecutive Ar+ ion bombardment to the sample. The evolution of the resulting ID/IG data as a function of the average distance between defects (LD) is shown in Fig. 15b. The ID/IG ratio has a non-monotonic dependence on LD, increasing with increasing LD up to LD 4 nm where ID/IG has a peak value, and then decreasing for LD > 4 nm. Such behavior is explained by the existence of two disorder-induced competing mechanisms contributing Copyright 2011 ACS. 2011 Since oxygen-containing functional groups can be well removed by a proper reduction route, what is the main reason for the low conductivity of rGO compared with that of graphene? As shown in Fig. 14, Gomez-Navarro et al. [50] identified the atomic scale features of an rGO monolayer that was reduced by hydrogen-plasma [51]. The layers are found to comprise defect-free graphene areas with sizes of a few nanometers interspersed with defective areas dominated by clustered pentagons and heptagons. Similar to other lowdimensional carbon nanostructures like carbon nanotubes [132] and fullerenes [133], disorder and defects in graphene strongly affect its electronic properties, and thus account for the low conductivity of as-reduced rGO. Thus, if these lattice defects can be healed during reduction, the GO could possibly behave as perfect graphene. Several studies in this direction have been tried with the expectation of achieving much improved conductivity from GO. Lopez et al. [62] proposed a strategy to repair GO by CVD. The CVD was carried out using ethylene as a carbon source, under conditions that are very similar to those in the CVD synthesis of single-wall carbon nanotubes on SiO2 substrates, except for the presence of metal catalysts in the latter case. After the CVD, the CVD-GO has a more than 50-fold increase in electrical conductivity over the rGO prepared by traditional reduction methods. Unfortunately, the authors did not give any direct evidence of the restoration of the graphene structures. Recently, by MD simulation, Wang et al. [134] proposed a possible way to heal defects as well as doping graphene by 3223 Fig. 14 – Atomic resolution, aberration-corrected TEM image of a single layer H-plasma-reduced-GO membrane [50]. (a) Original image and (b) with color added to highlight the different features, (c) atomic resolution TEM image of a nonperiodic defect configuration, (d) partial assignment of the configurations in defective areas, the inset shows a structural model showing clearly the strong local deformations associated with defects. All scale bar 1 nm. CARBON 5 0 ( 2 0 1 2 ) 3 2 1 0 –3 2 2 8 Copyright 2010 Elsevier. 2010 3224 Fig. 15 – (a) Evolution of the first-order Raman spectra of a monolayer graphene sample deposited on an SiO2 substrate, subjected to ion bombardment with different doses (indicated next to the respective spectrum in units of Ar+/cm2), (b) the ID/ IG data points from the evolution as a function of the average distance LD between defects. The solid line is the result of a modeling calculation. The inset to (b) shows ID/IG vs LD plotted on a log scale for the LD axis for two ion-implanted graphite samples [138]. to the Raman D-band. As a result, the increase of ID/IG ratio might be caused by the rather small size of sp2 domains within the initial GO sheets. The increase in the size of sp2 domains results in the increase of ID/IG. But one condition should be confirmed that the area of sp2 domains is very small. As a result, according to the reported results, the healing effect, even if it exists, is rather weak and is far from the target to ‘repair’ rGO to form graphene. 5.3. ported results and the results on GO obtained by the same reduction treatment but with more severe degrees of oxidation. As a result, research on the production of high-quality graphene through oxidation-and-reduction should be a comprehensive study of both the control of the oxidation of the raw graphite and choosing the methods to reduce the GO. The former may be more important to determine the quality of rGO. Towards the synthesis of highly reducible GO 6. A brief conclusion can be given to the effects and mechanism of GO reduction as follows. Both functional groups and defects affect the conductivity of GO. Functional groups are relatively easy to remove, while defects, whether formed during oxidation or reduction, are difficult to heal by post-treatment. Furthermore, functional groups attached to edges and defects are more difficult to remove than those attached to graphitic areas. Thus, the concentration of lattice defects in the carbon plane is the key to determine whether a GO sheet can be well reduced. Where do defects come from? According to the simulation results proposed by Bagri et al. [127], if the carbon plane of GO is only covered by functional groups with no lattice defects, reduction can be realized by choosing a proper reduction method. Lattice defects in the carbon plane that remain after reduction are more likely formed during oxidation. Recently, Zhao et al. [34] and Xu et al. [139] reported mildly-oxidized GO (MOGO) produced by a modified Hummers method with a low oxidation degree of the graphite. Though the MOGO sheets are also highly functionalized according to their low C/O ratio, they preserve the structure of the conjugated carbon framework with relatively low defect concentrations. Thus, the MOGO can be reduced to become highly conductive rGO by hydrazine or HI reduction, both of which show much improved reduction effects compared with most of the re- Summary and prospects We have reviewed the reduction of GO to prepare graphenelike rGO. This is an attractive route for the mass-scale production and applications of graphene. Though the full reduction of GO to graphene is still hard to achieve, partial reduction of GO is rather easy and tens of reduction methods have been proposed. The accumulation of experimental phenomena and theoretical simulation results has provided clearer views of the structure and chemistry of graphene, GO and rGO, and this may be helpful in promoting the uses as well as the scientific understanding of the nature of graphene. Different functional groups in a GO sheet have different binding energies to the carbon plane according to the type and location of each group. Epoxy and hydroxyl groups located within a graphitic domain without lattice defects are relatively easy to remove, while those located on the defective sites and edges are hard to fully remove. A well-designed reduction procedure with a combination of chemical reduction and thermal annealing is possible to remove most of the functionalizations in a GO sheet with low defect concentrations. However, GO sheets with a high concentration of lattice defects are difficult to fully deoxygenate and the defects themselves are difficult to heal by post-treatment. As a result, a controllable oxidation during the production of GO is CARBON 5 0 ( 20 1 2 ) 3 2 1 0–32 2 8 needed to achieve highly reducible GO, which can be converted to graphene with high quality and good properties. The future research on the reduction of GO should mainly focus on two topics: (1) a much deeper understanding of the reduction mechanism and (2) how to control the oxidation of graphite and the reduction of GO. This is because that a controllable functionalization that can alter the properties of graphene to fulfill specific requirements in applications is equally important to obtain a non-defective graphene, for example, to change the gapless semi-metallic graphene into a semiconductor with proper band gap. The previous research on GO and rGO has inspired a possible way to achieve such change that GO and rGO show obvious semiconductor-like properties [11]. Recently, Eda et al. [140] and Pan et al. [76] reported a blue photoluminescence of GO (or rGO), which proves that a properly functionalized graphene sheet can be a semiconductor. Then the question is how we can obtain such functionalization of graphene by a reliable technique, but not an occasional observation. Research on the oxidation and reduction combined with a deep understanding of graphene structure may give us the key to realize good control of the attaching and elimination of functional groups to some specific locations on the carbon plane. Further research on the controllable oxidation and reduction of graphene may facilitate the applications of graphene as semiconductors used in transistor and photo-electronic devices. Acknowledgements This work was supported by the Key Research Program of Ministry of Science and Technology, China (No. 2011CB932604), the National Natural Science Foundation of China (Nos. 51102243 and 50921004), and by the Chinese Academy of Sciences (KGCX2-YW-231). R E F E R E N C E S [1] Novoselov KS, Geim AK, Morozov SV, Jiang D, Zhang Y, Dubonos SV, et al. Electric field effect in atomically thin carbon films. Science 2004;306(5696):666–9. [2] Geim AK. Graphene: status and prospects. Science 2009;324(5934):1530–4. [3] Geim AK, Novoselov KS. 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