Use of near-infrared spectroscopy for the online monitoring of natural gas composition (hydrocarbons, water and CO2 content) at high pressure

IF 2.7 3区 化学 Q2 CHEMISTRY, ANALYTICAL Vibrational Spectroscopy Pub Date : 2024-01-19 DOI:10.1016/j.vibspec.2024.103653
Larissa F. Torres , Moema A. Damascena , Matheus M.A. Alves , Klebson S. Santos , Elton Franceschi , Cláudio Dariva , Vinicius A. Barros , Darley C. Melo , Gustavo R. Borges
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Abstract

The natural gas production from Brazilian pre-salt fields imposed new challenges for petrochemical industry. Actual treatment facilities are not adequate for this new scenario and studies have been conducted to apply new adsorbents materials and membranes for water and CO2 removal from natural gas at high pressures. To better develop such investigations, sensors for on-line monitoring of natural gas properties like CO2 and water content are important, since their presence affects the quality of the final product. Near infrared (NIR) spectroscopy associated to chemometric models (partial least squares) were employed for on-line monitoring of representative natural gas systems (methane/CO2, methane/water and methane/CO2/water) and a real natural gas at temperature and pressure ranges from 20 to 60 °C and 10 to 200 bar, respectively, water content up to gas saturation and CO2 content up to 50 wt%. Water solubility values used as reference for NIR Spectrometer calibration in model systems were taken from the literature and for real natural gas calculated with Cubic Plus Association (CPA) Equation of State (EoS), while CO2 content was experimentally controlled aiming to calibrate the chemometric models in the full range of pressure and temperature. Several strategies were adopted for the chemometric model’s development to obtain the best correlation between NIR spectra and experimental data. Results indicate good correlation in both calibration and validation steps attaining linear correlation coefficients (R2) higher than 0.96 for all systems investigated. The proposed methodology is a potential tool for on-line monitoring of natural gas composition, including CO2 and water content, at high-pressures and can be applied at petrochemical industries or in laboratories, dispensing sampling or any sample preparation.

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利用近红外光谱在线监测高压天然气成分(碳氢化合物、水和二氧化碳含量
巴西前盐田的天然气生产给石化工业带来了新的挑战。实际的处理设施无法满足这种新情况的需要,因此人们开始研究应用新的吸附材料和薄膜,在高压条件下去除天然气中的水和二氧化碳。为了更好地开展此类研究,在线监测天然气特性(如二氧化碳和水含量)的传感器非常重要,因为它们的存在会影响最终产品的质量。近红外(NIR)光谱与化学计量模型(偏最小二乘法)相结合,用于在线监测具有代表性的天然气系统(甲烷/CO2、甲烷/水和甲烷/CO2/水)和实际天然气,温度和压力范围分别为 20 至 60 °C 和 10 至 200 巴,水含量最高可达气体饱和状态,二氧化碳含量最高可达 50 wt%。模型系统中用作近红外光谱仪校准参考的水溶解度值取自文献,而实际天然气的水溶解度值则是通过立方加权协会(CPA)状态方程(EoS)计算得出的,而二氧化碳含量则是通过实验控制的,目的是在全压力和温度范围内校准化学计量模型。为获得近红外光谱与实验数据之间的最佳相关性,化学计量学模型的开发采用了多种策略。结果表明,校准和验证步骤都具有良好的相关性,所有研究系统的线性相关系数 (R2) 都高于 0.96。所提出的方法是在高压条件下在线监测天然气成分(包括二氧化碳和水含量)的潜在工具,可应用于石化工业或实验室、分配采样或任何样品制备。
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来源期刊
Vibrational Spectroscopy
Vibrational Spectroscopy 化学-分析化学
CiteScore
4.70
自引率
4.00%
发文量
103
审稿时长
52 days
期刊介绍: Vibrational Spectroscopy provides a vehicle for the publication of original research that focuses on vibrational spectroscopy. This covers infrared, near-infrared and Raman spectroscopies and publishes papers dealing with developments in applications, theory, techniques and instrumentation. The topics covered by the journal include: Sampling techniques, Vibrational spectroscopy coupled with separation techniques, Instrumentation (Fourier transform, conventional and laser based), Data manipulation, Spectra-structure correlation and group frequencies. The application areas covered include: Analytical chemistry, Bio-organic and bio-inorganic chemistry, Organic chemistry, Inorganic chemistry, Catalysis, Environmental science, Industrial chemistry, Materials science, Physical chemistry, Polymer science, Process control, Specialized problem solving.
期刊最新文献
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