9 research outputs found

    Study of Intermolecular Interaction between Small Molecules and Carbon Nanobelt: Electrostatic, Exchange, Dispersive and Inductive Forces

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    The conjugated structure of carbon is used in chemical sensing and small molecule catalysis because of its high charge transfer ability, and the interaction between carbon materials and small molecules is the main factor determining the performance of sensing and catalytic reactions. In this work, Reduced Density Gradient (RDG) and Symmetry-Adapted Perturbation Theory (SAPT) energy decomposition methods were used in combination to investigate the heterogeneity of catalytic substrates commonly used in energy chemistry with [6, 6] the carbon nanobelt ([6, 6] CNB, the interaction properties and mechanisms inside and outside the system). The results show that most of the attractive forces between dimers are provided by dispersive interactions, but electrostatic interactions cannot be ignored either. The total energy of the internal adsorption of [6, 6] CNB was significantly smaller than that of external adsorption, which led to the small molecules being more inclined to adsorb in the inner region of [6, 6] CNB. The dispersive interactions of small molecules adsorbed on [6, 6] CNB were also found to be very high. Furthermore, the dispersive interactions of the same small molecules adsorbed inside [6, 6] CNB were significantly stronger than those adsorbed outside. In [6, 6] CNB dimers, dispersion played a major role in the mutual attraction of molecules, accounting for 70% of the total attraction

    Classification, identification, and reservoir characteristics of intermediate mafic lava flows: a case study in Dongling area, Songliao Basin

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    Intermediate mafic lava is a special oil and gas reservoir. While its internal structure is an important factor affecting the reservoir properties, the identification of facies and understanding of the relationship between facies architecture and reservoir are limited. This study evaluated the intermediate mafic lava flows of the Yingcheng Formation in the Dongling area of Songliao Basin by analyzing drilling cores, corresponding thin sections, and scanning electron microscope (SEM) images, as well as well-logging and seismic attributes. We also performed helium gas experiments and high-pressure mercury intrusion (HPMI) analysis to assess the physical properties and pore structure of the reservoir, respectively. The results showed that intermediate mafic lava flows develop tabular lava flow, compound lava flow, and hyaloclastite. Three facies showed present diverse well-logging and seismic responses. The intermediate mafic lava facies architecture was divided into crater-proximal facies (CF-PF), medial facies (MF), and distal facies (DF), which were characterized by their vesicles and joints and could be identified through their seismic attributes. The reservoir spaces including vesicles, amygdale inner pores, joint fissures, and dissolution pores predominantly showed oil and gas accumulation. The results of the tests of the reservoir’s physical properties showed that the reservoir quality was best in the CF-PF, which is the main target of oil and gas exploration
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