Supporting dataset with respect to Raman spectroscopic analysis of Palaeogene charcoals from Malcolm's Point, Isle of Mull, Scotland.
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Raman spectroscopic data (raw and processed) for Palaeogene charcoal samples A1, A2, B, and A1 thin section (A1-TS), including application of FWHMRa geothermometry as per Theurer et al. (2022). Spectral data collected and processed in Renishaw WiRE 3.4 software. Those data presented in sheet 'HDHG Method 3' refer to spectral data processed in MATLAB, implementing 'peak-fit' and secondary deconvolution codes, as per O'Haver (2015, 2022) and Schito et al. (2020, 2022), respectively. O'Haver, T. (2015). A Pragmatic Introduction to Signal Processing [Online]. Retrieved from https://terpconnect.umd.edu/~toh/spectrum/CurveFittingC.html O'Haver, T. (2022). peakfit.m [Code]. MATLAB Central File Exchange. Retrieved from https://www.mathworks.com/matlabcentral/fileexchange/23611-peakfit-m Schito, A. & Corrado, S. (2020). An automatic approach for characterization of the thermal maturity of dispersed organic matter Raman spectra at low diagenetic stages. Journal of the Geological Society of London - Special Publications. 484, 107–119. doi: 10.1144/SP484.5 Schito, A., Pensa, A., Corrado, S., Vona, A., Trolese, M., Morgavi, D., et al. (2022). Calibrating carbonization temperatures of wood fragments embedded within pyroclastic density currents through Raman spectroscopy. Minerals, 12, 203. doi: 10.3390/min12020203 Theurer, T., Naszarkowski, N., Muirhead, D. K., Jolley, D. & Mauquoy, D. (2022). Assessing modern Calluna heathland fire temperatures using Raman spectroscopy: Implications for past regimes and geothermometry. Frontiers in Earth Science, 10, 827933. doi: 10.3389/feart.2022.827933
拉曼光谱数据(含原始与处理后版本)对应古近纪炭质样品A1、A2、B及A1薄片样本(A1-TS),其中包含遵循Theurer等人(2022)提出的方法开展的拉曼半高全宽(FWHMRa)地质测温法应用流程。光谱数据通过雷尼绍(Renishaw)WiRE 3.4软件采集并处理。标注为"HDHG Method 3"工作表中的数据,指采用MATLAB软件处理的光谱数据,分别依照O'Haver(2015、2022)与Schito等人(2020、2022)的方法,实现了峰值拟合(peak-fit)与二次反褶积编码处理。 O'Haver, T. (2015). 信号处理实用导论 [联机文献]. 检索自:https://terpconnect.umd.edu/~toh/spectrum/CurveFittingC.html O'Haver, T. (2022). peakfit.m [代码]. MATLAB Central 文件交换中心. 检索自:https://www.mathworks.com/matlabcentral/fileexchange/23611-peakfit-m Schito, A. 与 Corrado, S. (2020). 低成岩阶段分散有机质拉曼光谱热成熟度表征的自动化方法. 伦敦地质学会志-特刊, 484, 107–119. DOI: 10.1144/SP484.5 Schito, A., Pensa, A., Corrado, S., Vona, A., Trolese, M., Morgavi, D. 等 (2022). 基于拉曼光谱校准火山碎屑密度流中木质碎片的碳化温度. 矿物, 12, 203. DOI: 10.3390/min12020203 Theurer, T., Naszarkowski, N., Muirhead, D. K., Jolley, D. 与 Mauquoy, D. (2022). 基于拉曼光谱评估现代帚石楠灌丛火灾温度:对古火灾活动与地质测温的启示. 地球科学前沿, 10, 827933. DOI: 10.3389/feart.2022.827933



