Hao Zhang, Haiyue Cao, Liang Yuan, Xiaoyu Ding, Shuai Zhang, Kuo Li, Junmin Sun, Qinfu Liu
{"title":"合成石墨化过程中煤基石墨随温度变化的结构演变","authors":"Hao Zhang, Haiyue Cao, Liang Yuan, Xiaoyu Ding, Shuai Zhang, Kuo Li, Junmin Sun, Qinfu Liu","doi":"10.1021/acs.energyfuels.4c02240","DOIUrl":null,"url":null,"abstract":"A series of synthetic coal-based graphite (SCG) samples were prepared from anthracite, with heating temperatures ranging from 1400 to 2900 °C, and the structural evolution during graphitization was investigated. The overall graphitization process can be divided into three phases based on the parameters of XRD and Raman spectroscopy: (1) The carbonization phase (below 1400 °C) with disordered carbon structure: A carbon-rich process occurs in this period; however, the disordered structure with turbulent lattice fringes remains, as evidenced by the values of d<sub>002</sub>, FWHM (002), and I<sub>D1</sub>/I<sub>G</sub> of the sample heated at 1400 °C, which are 0.3590 nm, 4.64° (2θ), and 1.21, respectively. (2) The initial graphitization phase (1400–2300 °C) with more aligned and equidistant layers lattice fringes shown in TEM images: The platelets of microcrystalline graphite are dominated with less than 3 μm in length. The parameter variations of d<sub>002</sub>, FWHM (002), and I<sub>D1</sub>/I<sub>G</sub> are significant, which are 0.3389–0.3590 nm, 0.64–4.64° (2θ), and 0.27–1.21, respectively. (3) The “flake-like” graphitization phase (2300–2900 °C) with perfect straight three-dimensional (3D) lattice fringes: The platelets of graphite are generally >5 μm in length. A robust edge-to-edge coalescence process occurs at this stage, leading to the formation of large 3D-ordered graphite crystals. However, the variation of d<sub>002</sub>, FWHM (002), and I<sub>D1</sub>/I<sub>G</sub> are stable and narrow ranges, which are 0.3373–0.3389 nm, 0.41–0.64° (2θ), and 0.06–0.27, respectively. The temperature of 2300 °C is a mutation point in the structural transformation during the synthetic graphitization process, at which the underlying mechanism of molecular dynamics for carbon atom reorganization needs to be further studied. This study provides valuable insight for precisely managing structural conversion in future synthetic coal-based graphitization processes.","PeriodicalId":35,"journal":{"name":"Energy & Fuels","volume":"5 1","pages":""},"PeriodicalIF":5.3000,"publicationDate":"2024-09-06","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":"{\"title\":\"Temperature-Dependent Structural Evolution of Coal-Based Graphite During Synthetic Graphitization Process\",\"authors\":\"Hao Zhang, Haiyue Cao, Liang Yuan, Xiaoyu Ding, Shuai Zhang, Kuo Li, Junmin Sun, Qinfu Liu\",\"doi\":\"10.1021/acs.energyfuels.4c02240\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"A series of synthetic coal-based graphite (SCG) samples were prepared from anthracite, with heating temperatures ranging from 1400 to 2900 °C, and the structural evolution during graphitization was investigated. The overall graphitization process can be divided into three phases based on the parameters of XRD and Raman spectroscopy: (1) The carbonization phase (below 1400 °C) with disordered carbon structure: A carbon-rich process occurs in this period; however, the disordered structure with turbulent lattice fringes remains, as evidenced by the values of d<sub>002</sub>, FWHM (002), and I<sub>D1</sub>/I<sub>G</sub> of the sample heated at 1400 °C, which are 0.3590 nm, 4.64° (2θ), and 1.21, respectively. (2) The initial graphitization phase (1400–2300 °C) with more aligned and equidistant layers lattice fringes shown in TEM images: The platelets of microcrystalline graphite are dominated with less than 3 μm in length. The parameter variations of d<sub>002</sub>, FWHM (002), and I<sub>D1</sub>/I<sub>G</sub> are significant, which are 0.3389–0.3590 nm, 0.64–4.64° (2θ), and 0.27–1.21, respectively. (3) The “flake-like” graphitization phase (2300–2900 °C) with perfect straight three-dimensional (3D) lattice fringes: The platelets of graphite are generally >5 μm in length. A robust edge-to-edge coalescence process occurs at this stage, leading to the formation of large 3D-ordered graphite crystals. However, the variation of d<sub>002</sub>, FWHM (002), and I<sub>D1</sub>/I<sub>G</sub> are stable and narrow ranges, which are 0.3373–0.3389 nm, 0.41–0.64° (2θ), and 0.06–0.27, respectively. The temperature of 2300 °C is a mutation point in the structural transformation during the synthetic graphitization process, at which the underlying mechanism of molecular dynamics for carbon atom reorganization needs to be further studied. 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Temperature-Dependent Structural Evolution of Coal-Based Graphite During Synthetic Graphitization Process
A series of synthetic coal-based graphite (SCG) samples were prepared from anthracite, with heating temperatures ranging from 1400 to 2900 °C, and the structural evolution during graphitization was investigated. The overall graphitization process can be divided into three phases based on the parameters of XRD and Raman spectroscopy: (1) The carbonization phase (below 1400 °C) with disordered carbon structure: A carbon-rich process occurs in this period; however, the disordered structure with turbulent lattice fringes remains, as evidenced by the values of d002, FWHM (002), and ID1/IG of the sample heated at 1400 °C, which are 0.3590 nm, 4.64° (2θ), and 1.21, respectively. (2) The initial graphitization phase (1400–2300 °C) with more aligned and equidistant layers lattice fringes shown in TEM images: The platelets of microcrystalline graphite are dominated with less than 3 μm in length. The parameter variations of d002, FWHM (002), and ID1/IG are significant, which are 0.3389–0.3590 nm, 0.64–4.64° (2θ), and 0.27–1.21, respectively. (3) The “flake-like” graphitization phase (2300–2900 °C) with perfect straight three-dimensional (3D) lattice fringes: The platelets of graphite are generally >5 μm in length. A robust edge-to-edge coalescence process occurs at this stage, leading to the formation of large 3D-ordered graphite crystals. However, the variation of d002, FWHM (002), and ID1/IG are stable and narrow ranges, which are 0.3373–0.3389 nm, 0.41–0.64° (2θ), and 0.06–0.27, respectively. The temperature of 2300 °C is a mutation point in the structural transformation during the synthetic graphitization process, at which the underlying mechanism of molecular dynamics for carbon atom reorganization needs to be further studied. This study provides valuable insight for precisely managing structural conversion in future synthetic coal-based graphitization processes.
期刊介绍:
Energy & Fuels publishes reports of research in the technical area defined by the intersection of the disciplines of chemistry and chemical engineering and the application domain of non-nuclear energy and fuels. This includes research directed at the formation of, exploration for, and production of fossil fuels and biomass; the properties and structure or molecular composition of both raw fuels and refined products; the chemistry involved in the processing and utilization of fuels; fuel cells and their applications; and the analytical and instrumental techniques used in investigations of the foregoing areas.