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原油主要化学成分对原油平均分子量的影响 被引量:4
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作者 刘伟 《黑龙江科技信息》 2011年第5期31-31,115,共2页
原油平均分子量是原油一项重要的综合评价指标,它反映原油多方面理化性质。原油平均分子量取决于原油化学成分。这里用采用大量分析数据,用散点法初步研究了原油各类化学成分对原油平均分子量的影响,发现各成分的影响情况各有特点。对... 原油平均分子量是原油一项重要的综合评价指标,它反映原油多方面理化性质。原油平均分子量取决于原油化学成分。这里用采用大量分析数据,用散点法初步研究了原油各类化学成分对原油平均分子量的影响,发现各成分的影响情况各有特点。对于深入研究原油理化性质及原油评价具有重要意义。 展开更多
关键词 化学成分 原油平均分子 散点法 评价
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分子动力学模拟研究方解石表面润湿性反转机理 被引量:4
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作者 刘汝敏 康晓东 +2 位作者 辛晶 吴英 柴汝宽 《原子与分子物理学报》 CAS 北大核心 2021年第1期32-41,共10页
利用分子动力学模拟技术从分子尺度探究方解石表面润湿性反转机理.首先,研究方解石表面润湿性反转过程;而后,从原油分子-方解石表面与原油分子-原油分子/水分子相互作用两个方面系统揭示方解石表面润湿性反转机理.结果:(1)水分子能够驱... 利用分子动力学模拟技术从分子尺度探究方解石表面润湿性反转机理.首先,研究方解石表面润湿性反转过程;而后,从原油分子-方解石表面与原油分子-原油分子/水分子相互作用两个方面系统揭示方解石表面润湿性反转机理.结果:(1)水分子能够驱离方解石表面弱吸附的非极性分子造成润湿性的改变,但不能驱离强吸附的极性分子使润湿性反转难以实现;(2)原油分子极性越强与方解石表面相互作用越强,极性分子与方解石表面之间主要为静电力,非极性分子与方解石表面之间主要为范德华力;(3)原油分子极性越相近分子之间的相互作用越强,分子极性相差越大分子之间的相互作用越弱.非极性分子之间主要是范德华力,极性分子之间主要是静电力;(4)原油分子在方解石表面和水分子的共同作用下形成乙酸-吡啶-水-甲苯-己烷的稳定吸附序列.本研究为靶向提高采收率技术的设计与应用提供理论基础. 展开更多
关键词 分子动力学模拟 方解石表面 原油分子 润湿性 反转机理
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Molecular Characterization of Hydrotreated Atmospheric Residue Derived from Arabian Heavy Crude by GC FI/FD TOF MS and APPI FT-ICR MS 被引量:4
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作者 Diao Rui Wang Wei +3 位作者 Wang Naixin Liu Zelong Dai Lishun Tian Songbai 《China Petroleum Processing & Petrochemical Technology》 SCIE CAS 2012年第4期80-88,共9页
High resolution mass spectrometry in combination with distillation and SARA fractionation provides us an opportunity for in-depth understanding about the hydrotreating process at the molecular level. In this study, th... High resolution mass spectrometry in combination with distillation and SARA fractionation provides us an opportunity for in-depth understanding about the hydrotreating process at the molecular level. In this study, the atmospheric residue derived from Arabian heavy crude and its hydrotreated products were initially subjected to distillation and SARA fractionation. The saturates were characterized by GC FI/FD TOF MS. The aromatics and resins were characterized by APPI FT-ICR MS. Compositional changes of different compounds (paraffins, naphthenes, aromatic hydrocarbons, and heteroatomic compounds) contained in different distillates (vacuum gas oil, vacuum residue) were obtained. More detailed knowledge about the hydrotreating process was achieved. 展开更多
关键词 hydrotreating petroleum residue FT-ICR MS GC FI/FD TOF MS
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Comparison of Carboxylic Acids in Some Crude Oils and Their Diesel Distillates and VGOs:Characterized by Negative-Ion Electrospray Ionization Fourier Transform Ion Cyclotron Resonance Mass Spectrometry (Negative-Ion ESI FT-ICR MS) 被引量:3
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作者 Wang Zhenhua Tu Yongshan 《China Petroleum Processing & Petrochemical Technology》 SCIE CAS 2011年第3期8-15,共8页
Three high-acidity crudes, Dar, SZ36-1, and QHD326, were separated through distillation into several fractions, including diesel distillates, and VGOs. Samples were characterized by negative-ion ESI FT-ICR MS. The O2 ... Three high-acidity crudes, Dar, SZ36-1, and QHD326, were separated through distillation into several fractions, including diesel distillates, and VGOs. Samples were characterized by negative-ion ESI FT-ICR MS. The O2 class species (petroleum carboxylic acids), which have a close relationship with corrosion of equipment caused by high-acidity crudes, were put in the focus of attention and were discussed in this paper. Monocyclic, bicyclic, and tricyclic naphthenic acids are the main types of petroleum carboxylic acids in naphthenic-base crudes (SZ36-1 and QHD326). But the main types of petroleum carboxylic acids in paraffinic-base crude (Dar) are aliphatic acids and monocyclic naphthenic acids. The O2 class species in SZ36-1 and QHD326 are distributed in a wider range and have bigger DBE value (double-bond equivalence value) and carbon number than Dar. Bicyclic naphthenic acids have the highest proportion among petroleum carboxylie acids in diesel distillates, but monocyclic and tricyclic naphthenic acids also occupy a high proportion. Particularly, aliphatic acids in the diesel distillate of Dar still have high proportion among petroleum carboxylic acids. The distribution of petroleum carboxylic acids in VGO is basically identical. The bicyclic naphthenic acids assume the first place (about 25 m%), while the monocyclic and tricyclic naphthenic acids take the next place. The comparison of petroleum carboxylic acids in diesel distillates and VGOs has revealed that the molecules of carboxylic acids in VGOs are not only bigger but also more complicated. 展开更多
关键词 O2 class species petroleum carboxylic acids aliphatic acids naphthenic acid
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Environmantal Risk Phytoaccumulation of Arsenic in Spinacea Olaracea L, and Lactuca Sativa L
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作者 Mirsad Veladzic Fatima Muhamedagie Osman Perviz Ekrem Pehlic Enez Selimbegovic 《Journal of Environmental Science and Engineering(B)》 2015年第7期368-371,共4页
Pollution of the environment, particularly the soil, appears to be one of the major contemporary issues. In addition, many studies point to the involvement of ecological risk of heavy metals into the food chain throug... Pollution of the environment, particularly the soil, appears to be one of the major contemporary issues. In addition, many studies point to the involvement of ecological risk of heavy metals into the food chain through edible plants like Spinaceae oleraceae L. and Lactuca sativa L.. This paper presents the results of the "ex-situ" application of phytoacumulation on the soils of contaminated terrain using the plant species of spinach (Spinacea oleracea L.) and lettuce (Lactuca sativa L.). Sequestration of arsen from the soil by these plant species was observed through phytoaccumulation factor--PF and limit values (mg/kg). The main task and objective of this research was to establish the level of accumulation of toxic element As from the soil by plants and to calculate the PF factor of transfer. The experiment was set up in the control conditions where the soil from eight contaminated locations was placed in the experimental containers. The AAS method was used to analyze heavy metal in plant material and soil. PF factor values ranged from 0.1 to 1.0 which indicates that the spinach and lettuce plants rechargeable moderate compared to arsenic. 展开更多
关键词 PHYTOACCUMULATION Spinaceae oleraceae L. Lactuca sativa L. arsenic.
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Molecular characterization of sulfur compounds in some special sulfur-rich Chinese crude oils by FT-ICR MS 被引量:1
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作者 LU Hong SHI Quan +4 位作者 MA QingLin SHI Yang LIU JinZhong SHENG GuoYing PENG PingAn 《Science China Earth Sciences》 SCIE EI CAS 2014年第6期1158-1167,共10页
Routine GC/MS analysis may apply to the volatilized Low-Molecular-Weight compounds in saturate and aromatic hydrocarbon fractions;thus,relative studies using this technique inevitably bring about some limitations on d... Routine GC/MS analysis may apply to the volatilized Low-Molecular-Weight compounds in saturate and aromatic hydrocarbon fractions;thus,relative studies using this technique inevitably bring about some limitations on distribution of miscellaneous sulfur atom.In this article,Fourier Transform Ion Cyclotron Resonance Mass Spectrometry(FT-ICR MS)with high resolution is employed to investigate the distribution of organic sulfur compounds(OSCs)in the crude oil typically derived from the Eogene carbonate-evaporite sediments with further chemical compositional characterization in molecular level by miscellaneous atomic type,carbon number,and double bond equivalent(DBE).A variety of miscellaneous atomic types with S1,S2,S3,OS,OS2,O2S,O2S2,NS,and NOS etc.(S1 means those OSCs with one sulfur atom in a molecule)were identified in OSCs in these oil samples.High levels of alkyl thioether series compounds with one ring structure were presented mainly in the crude oil in the Jianghan Basin whereas high amounts of benzothiophene,dibenzothiophene etc.compounds with higher values in DBE and carbon number range occurred in the sulfur-rich heavy oil in the Jinxian Sag.Although carbonate-evaporite sediments deposited in the saline lacustrine facies in the Eogene basin both occurred in the Jinxian Sag and Jianghan Basin,obviously,they possess different chemical diagenetic pathway of sulfur under various microbial reactions,leading to diverse distributional characteristics on biomarkers,OSCs,and even different hydrocarbon generation mechanism of immature crude oil. 展开更多
关键词 ESI FT-ICR MS organic sulfur compounds sulfur-rich oil Jianghan Basin Jinxian Sag
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