Element partitioning and stabilization for impurities removal between liquid silicon and silicate melts: Ab initio insights into electronic structure (English)
- New search for: Sun, Yiwei
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- New search for: Sun, Yiwei
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In:
Journal of Molecular Liquids
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400
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2024
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ISSN:
- Article (Journal) / Electronic Resource
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Title:Element partitioning and stabilization for impurities removal between liquid silicon and silicate melts: Ab initio insights into electronic structure
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Contributors:Sun, Yiwei ( author ) / Qian, Guoyu ( author ) / Pang, Sheng ( author ) / Guo, Jianwei ( author ) / Wang, Dong ( author ) / Wang, Zhi ( author )
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Published in:
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Publisher:
- New search for: Elsevier B.V.
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Publication date:2024-03-23
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ISSN:
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DOI:
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Type of media:Article (Journal)
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Type of material:Electronic Resource
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Language:English
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Keywords:
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Source:
Table of contents – Volume 400
The tables of contents are generated automatically and are based on the data records of the individual contributions available in the index of the TIB portal. The display of the Tables of Contents may therefore be incomplete.
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Fluid revisited: An overlook of a method for solubility measurements in supercritical fluids based on chromatography retentionPokrovskiy, Oleg / Rostovschikova, Irina / Usovich, Oleg / Ustinovich, Konstantin et al. | 2024
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Fundamental properties and intermolecular interaction of triethylene glycol + ethylenediamine aqueous solution for CO2 captureWang, Yuting / Zhang, Yunlong / Zhang, Pengyu / Sun, Qian / Dong, Ye / Chai, Liming / Wang, Xiaoyu / Wang, Enna / Fu, Xupeng / Wu, Zhaojun et al. | 2024
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Efficient and selective absorption of NH3 by supramolecular OHP[5]-based ternary deep eutectic solventsGong, Wen-Qiang / Sun, Ming-Shuai / Li, Jun / Gong, Qiu-Ping / Fu, Yu-Xuan / Zhou, Yan / Tao, Duan-Jian et al. | 2024
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Investigation of ferulic acid recovery from enzymatic hydrolysate of wheat bran using various solvents and liquid-liquid extraction assisted by membrane contactorChadni, Morad / Haudrechy, Arnaud / Couvreur, Julien / Allais, Florent et al. | 2024
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Mutual role of dodecylbenzene sulfonic acid on enhanced oil recovery and asphaltene inhibition in low salinity medium: Experimental and XDLVO studyNajari, H. / Sanati, A. et al. | 2024
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Editorial Board| 2024
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Dual tunability of selective reflection by light and electric field for self-organizing materialsMrukiewicz, Mateusz / Cigl, Martin / Perkowski, Paweł / Karcz, Jakub / Hamplová, Věra / Bubnov, Alexej et al. | 2024
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Studies on newly developed hBN/graphene-based nano-fluids supported by cryogenic cooling conditions in improving the tribological performance of Ti6Al4V alloyKorkmaz, Mehmet Erdi / Rai, Ritu / Demirsöz, Recep / Picak, Sezer / Vashishtha, Govind / Günay, Mustafa et al. | 2024
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Dual-frequency-addressable photochromic cholesteric mixture with photo- and electro-switchable optical propertiesBobrovsky, Alexey / Shibaev, Valery / Bezborodov, Vladimir / Mikhalyonok, Sergei / Arol, Aliaksandr / Cigl, Martin / Hamplová, Věra / Bubnov, Alexej et al. | 2024
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GC–MS identification of DR31 textile dye degradation products during its efficient electrochemical removal from wastewater mediaAbo-Ayad, Zahraa A. / Hussein, Modather F. / Zayed, Mohamed A. / Abdelraheem, Omnia H. et al. | 2024
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Rheological behavior of hydrophobic association polyacrylamides with high salt resistance and corrosion inhibition: Cross-linking modification based on trace dopamine hydrochloride derivativesJi, Kuan / Jia, Weina / He, Guangling / Chen, Guobo / Yu, Liangmin et al. | 2024
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Studies on thermodynamics properties of binary mixtures of amyl acetate with propanol at T = 298.15 K to 318.15 KVerma, Sweety / Rani, Manju / Song, Hojun / Maken, Sanjeev et al. | 2024
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Research progress of surface-active ionic liquids for drug deliveryZhen, Dawei / Zhang, Miaomiao / Liu, Fengmao / Peng, Qingrong et al. | 2024
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Molecular dynamics investigation of the effect of nanostructured surfaces on flow boilingMiao, Shanshan / Xia, Guodong et al. | 2024
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Surface engineering of halloysite with PAMAM dendrimer via divergent and convergent synthetic routes: Quantitative and qualitative analysisKanani-Jazi, Mohammad Hassan / Akbari, Somaye / Stawski, Dawid et al. | 2024
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Inhibition of asphaltene aggregation using deep eutectic solvents: COSMO-RS calculations and experimental validationKumar, Nikhil / Mohan, Mood / Smith, Jeremy C. / Simmons, Blake A. / Singh, Seema / Banerjee, Tamal et al. | 2024
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Organic electrolytes in electrochemical supercapacitors: Applications and developmentsAcharjee, Animesh / Saha, Bidyut et al. | 2024
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Investigation of Alkane-Assisted dodecylamine on flotation desilication of magnesite Tailings: Molecular dynamics simulations and model optimizationXue, Zhonghua / Feng, Yali / Li, Haoran et al. | 2024
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Osmolyte-specific counteraction of ethanol-induced aggregation and structure-function distortion of catalaseManzoor, Usma / Bashir Hajam, Ishfaq / Ali Dar, Tanveer et al. | 2024
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Solubility evaluation of palm-based Mono-diacylglycerols (MDAGs) in food grade solvent (hexane, ethanol, acetone, water) using QSPR model approachNadjamoeddin, Gina Libria / Faridah, Didah Nur / Andarwulan, Nuri / Hariyadi, Purwiyatno / Khotib, Mohammad et al. | 2024
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Theoretical study on symmetric and asymmetric stacking in the self-assembly of bola-amphiphilic peptides into membranes with mixtures of EF4E and KF4Kde Sousa, Elias Rafael / Colherinhas, Guilherme et al. | 2024
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Fabrication of 3D framework of KIT-6 with CuO NPs for catalytic reduction of 4-nitrophenol and methylene blueAslam, Sobia / Subhan, Fazle / Yan, Zifeng / Zada, Amir / Ibrahim, Mohammad / Alam, Manawwer / Yaseen, Muhammad / Liu, Zhen et al. | 2024
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Thermal equilibrium time as a novel characteristic of nanofluid evaluation: An experimental investigation of distilled water-based binary and ternary nanofluidsAlshibil, Ahssan M.A. / Víg, Piroska / Farkas, István et al. | 2024
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Study on OH radical oxidation of 4H-SiC in plasma based on ReaxFF molecular dynamics simulationYan, Dongxiao / Huang, Hui / Huang, Yuxiang / Yang, Hao / Duan, Nian et al. | 2024
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Investigation of TPEG comb polymer as filtration and rheological additives for high-temperature water-based drilling fluidYang, Jie / Sun, Jinsheng / Wang, Ren / Qu, Yuanzhi / Liu, Fan / Feng, Xiaohua / Wang, Haohui / Yang, Zexing / Ren, Han / Liu, Luman et al. | 2024
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Unveiling ionic structure in the LiF-NdF3 molten salt system as determined by Raman spectroscopy and quantum chemical calculationsLin, Ming / Guan, Jinzhao / Aziz Diop, Mouhamadou / Zhao, Xiaoyang / Ma, Shifang / Li, Yunliang / Chen, Peng et al. | 2024
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Structure and activity of amphiphilic PEO-PPO-based polymeric micelles and gels incorporating host–guest complexes of miltefosine as novel formulations for the treatment of leishmaniasisDirany, Zeinab / Smith, Gregory N. / Aydillo, Carlos / Nguewa, Paul / González-Gaitano, Gustavo et al. | 2024
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Viscosities of fatty acid esters: A study on various semi-empirical modelsZhu, Chenyang / Gan, Wei / Wu, Zilin / Chen, Guangjin / He, Maogang / Yang, Tao et al. | 2024
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Entropy-driven polymer collapse on increasing the temperature: The case of poly(N-vinylcaprolactam)Graziano, Giuseppe et al. | 2024
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Preparation and enhanced oil recovery study of amphiphilic Janus nanosheetsHuang, Zhixue / Yang, Huan / Ye, Zhi / Zheng, Lijun / Wang, Xiaoyu / Jiang, Wenxue / Liu, Chong / Yu, Xiaorong / Su, Gaoshen et al. | 2024
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Comparison of trifluoromethyl- and pentafluoroethyl-substituted dicyanoimidazolide lithium salts–their association and electrochemical properties in oligo(ethylene glycols) of different chain lengthBroszkiewicz, Marek / Zalewska, Aldona / Karpierz-Marczewska, Ewelina / Niedzicki, Leszek et al. | 2024
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Using the modified Pitzer model to analyze the solubilities of sodium and potassium halides in aqueous mixtures of amides (Formamide, N-methylformamide and N-Methylacetamide) at T = 298.15 KHernández-Luis, Felipe / Lovera, Jorge A. / Rodríguez-Raposo, Raquel / Choque, Limber A. et al. | 2024
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Ligand-Assisted self-assembly of colloidal Ag2S nanoparticlesRempel, Svetlana V. / Vorontsova, Ekaterina S. / Kuznetsova, Yulia V. / Rempel, Andrey A. et al. | 2024
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Micelles and structural variation of the solution synergistically changing the viscosity of sodium aluminate solutionsChen, Baoyin / Liu, Guihua / Qi, Tiangui / Fu, Zhenjiang / Shen, Leiting / Wang, Yiling / Peng, Zhihong / Zhou, Qiusheng et al. | 2024
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Comprehensive computational insights on the conformations, electronic properties and binding mechanism of mescaline: A hallucinogenic moleculeBhadoria, Poonam / Tiwari, Aastha / Jain, Alok / Ramanathan, Venkatnarayan et al. | 2024
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Exploring 4-chloro chalcone: Synthesis, spectroscopic, chemical reactivity, topological, hirshfeld surface, drug-Likeness, molecular docking and assessment of electronic properties in diverse solventsChakkaravarthy, P. / Glory, J. / Manikandababu, C.S. / Navaneethan, S. / Ramesh Kumar, Bharathi / Raja, M. et al. | 2024
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Concentrated aqueous solutions of multivalent macroions enhance the electrical double layer capacitance and differential capacitance of a planar supercapacitorMoraila-Martínez, Gloria Namibia / Elisea-Espinoza, Jonathan Josué / González-Tovar, Enrique / Guerrero-García, Guillermo Iván et al. | 2024
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Advanced analysis of the adsorption mechanism for sweet odorant on mouse and human olfactory receptors via statistical physics theoryBen Khemis, Ismahene / Aouaini, Fatma / Alruwaili, Amani / Knani, Salah / Saad Al-mugren, Kholoud / Ben Lamine, Abdelmottaleb et al. | 2024
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Development of green and sustainable ammonia sensor from xanthohumol extract-immobilized polylactic acid nanofibersAl-Senani, Ghadah M. / Al-Qahtani, Salhah D. et al. | 2024
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Invasive weed of Eupatorium Adenophora Spreng leaves extract as a novel efficient inhibitor for the corrosion of cold rolled steel in chloroacetic acid solutionWei, Gaofei / Deng, Shuduan / Xu, Dake / Xu, Juan / Shao, Dandan / Li, Xianghong et al. | 2024
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Effect of magnitude of voltage and magnetic field on memory effect in nematic phase of liquid crystal and their composites with aerosil and goethite nanoparticlesKónyová, Katarína / Miakota, Dmytro / Lacková, Veronika / Jeng, Shie-Chang / Węgłowska, Dorota / Agresti, Filippo / Kopčanský, Peter / Tomašovičová, Natália et al. | 2024
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Ultralow interfacial tension achieved by extended anionic surfactants with a short hydrophobic chainWang, Chen-Guang / Pan, Yi / Xu, Zhi-Cheng / Zhang, Lei / Zhang, Lu / Yang, Shuang-Chun et al. | 2024
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Analyzing synergy in combined influence of sorbitol and glycine betaine on protein Stability: Thermodynamic and mechanistic insightsArya, Anju / Rathee, Jyoti / Kishore, Nand et al. | 2024
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DES-igning the future of drug delivery: A journey from fundamentals to drug delivery applicationsKapre, Sumedha / Palakurthi, Sushesh Srivatsa / Jain, Ankit / Palakurthi, Srinath et al. | 2024
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Studies of Ni-Cr complexation in FLiBe molten salt using machine learning interatomic potentialsAttarian, Siamak / Morgan, Dane / Szlufarska, Izabela et al. | 2024
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A comprehensive investigation of green solutions for sustainable wastewater remediation: A reviewHublikar, Leena V. / Shilar, Fatheali A. / Suliphuldevara Mathada, Basavarajaiah / Ganachari, Sharanabasava V. et al. | 2024
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Molecular-level explanation of interactions of random and block polycarboxylic acid dispersants with bituminous coal in coal–water slurry through experiments and simulationsZhu, Junfeng / Li, Jinling / Yang, Jing / Meng, Ruizhi / Zhang, Guanghua / Ji, Haodong et al. | 2024
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Influence of cationic dimeric and trimeric-type surfactants on the aggregation behavior of water-soluble phthalocyanine: A combined experimental and computational studyEl-Khouly, Mohamed E. / El-Said, Waleed A. / Yildirim, Erol / El-Shafei, Ahmed et al. | 2024
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An emerging trend of ionic liquids in the separation of critical metals from spent lithium and nickel based batteriesMeshram, Pratima / Jaiswal, Richa V. / Abhilash / Baiju, C / Gardas, Ramesh L. et al. | 2024
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Amino-Functionalized Pluronic F127 micelles as a dual drug delivery nanostructure for controlled therapeutics releaseAkhlaghi, Neda / Najafpour-Darzi, Ghasem et al. | 2024
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Tuning the bulk behavior and 2D interfacial self-assembly of microgels by keggin-type polyoxometalate ionic specificityRubio-Andrés, Antonio / Bastos-González, Delfi / Fernandez-Rodriguez, Miguel Angel et al. | 2024
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Rheological modulation of a pH-responsive wormlike micelle driven by charge and cosurfactantJora, Manazael Zuliani / de Souza, Renato Nunes / da Silva Barbosa, Matheus / Speglich, Carlos / Sabadini, Edvaldo et al. | 2024
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Novel enhanced thermal capabilities of Cu-Al2O3/water hybrid nanofluid in an oblique U-shape cavity: On the molecular behaviour through vorticity analysisAsmadi, M.S. / Md. Kasmani, R. / Siri, Z. / Saleh, H. et al. | 2024
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Study of a high salt tolerant amphiphilic polymer and its salt thickening mechanismYang, Hongbin / Pan, Shilong / Jiang, Haizhuang / Zhang, Junyi / Li, Haocong / Xing, Luyao / Zhang, Yubin / Sarsenbekuly, Bauyrzhan / Kang, Wanli / Zhang, Xiangfeng et al. | 2024
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Element partitioning and stabilization for impurities removal between liquid silicon and silicate melts: Ab initio insights into electronic structureSun, Yiwei / Qian, Guoyu / Pang, Sheng / Guo, Jianwei / Wang, Dong / Wang, Zhi et al. | 2024
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Construction of lignosulphonate-containing polymersomes and prospects for their use for elemental sulfur encapsulationLugovitskaya, T.N. / Rogozhnikov, D.A. et al. | 2024
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Three kinds of apatite adsorbents prepared by co-precipitation for Pb (II) and Cd (II) removal from wastewater: performance, competitive effects and mechanismsChen, Haojie / Xiao, Ruihao / Huang, Danlian / Deng, Rui / Li, Ruijin / Chen, Yashi / Zhou, Wei et al. | 2024
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Modeling of the mixing energies of binaries (methyl ester - alcohol) according to different versions of the UNIFAC methodOrtega, Juan / Fernández, Luis / Domínguez, Leandro / Chaar, Manuel et al. | 2024
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Adsorption characteristics and molecular mechanisms of ionic organic pollutants on bone charLi, Yuyu / Wang, Mengyan / Shan, Yu / Liu, Jiale / Han, Lujia / Liu, Xian et al. | 2024
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Aqueous dispersions of highly conductive carbon nanomaterials: Unusual aggregation mechanismAl-Shaibah, Faozia Nasser / Meslam, Mentallah / Youssry, Mohamed et al. | 2024
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Modeling H2S solubility in aqueous MDEA, MEA and DEA solutions by the electrolyte SRK-CPA EOSMehdizade, Niloufar / Bonyadi, Mohammad / Darvishi, Parviz / Shamsi, Mohammad et al. | 2024
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A comprehensive experimental and simulation study of zeta potential at carbonate-brine interface for calcite and dolomite particlesZarean, Mohsen / Parsaei, Rafat / Kalantariasl, Azim et al. | 2024
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Synergising nanoparticles and low salinity waterflooding for enhanced oil recovery: A state-of-the-art reviewArain, Aftab Hussain / Negash, Berihun Mamo / Yekeen, Nurudeen / Farooqi, Ahmad Salam / Alshareef, Rayed S. et al. | 2024
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Thermodynamic optimization of KCl-LiCl-LaCl3 with ionic two-sublattice model for liquidHao, Liangyan / Sridar, Soumya / Xiong, Wei et al. | 2024
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Effect of magnetic field on the apparent viscosity of water-in-oil waxy crude oil emulsionZhu, Zuoliang / Hou, Lei / Zhang, Xinru / Liu, Jiaquan / Sun, Xingshen / Xiong, Yifan et al. | 2024