Journal articles on the topic 'Molecular adsorption'
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Zhong, Shuying, Fanghua Ning, Fengya Rao, Xueling Lei, Musheng Wu, and Lang Zhou. "First-principles study of nitrogen and carbon monoxide adsorptions on silicene." International Journal of Modern Physics B 30, no. 25 (September 28, 2016): 1650176. http://dx.doi.org/10.1142/s0217979216501769.
Full textWanaguru, Prabath, Asok K. Ray, and Qiming Zhang. "Influence of H, H2, O and O2 on Armchair SiGe Nanotubes: A Theoretical Study." Journal of Nanoscience and Nanotechnology 16, no. 4 (April 1, 2016): 3447–56. http://dx.doi.org/10.1166/jnn.2016.12342.
Full textZhao, Fei, XiShang Sun, Ruifeng Lu, and Lihua Kang. "Adsorption of methanol, methanal, toluene, ethylbenzene, and styrene in zeolites: a grand canonical Monte Carlo simulation study." Canadian Journal of Chemistry 95, no. 12 (December 2017): 1241–47. http://dx.doi.org/10.1139/cjc-2017-0218.
Full textGodo, Masazumi, Takeshi Takatsuka, Mutsuya Tomonari, Kunio Miura, Seiichi Takami, Momoji Kubo, and Akira Miyamoto. "Adsorption Behavior of Chemical Contaminants by Molecular Simulation." Journal of the IEST 46, no. 1 (September 14, 2003): 98–102. http://dx.doi.org/10.17764/jiet.46.1.7450w638377v5872.
Full textLiu, Minqin, Yang Ding, Shimeng Peng, Yang Lu, Zhi Dang, and Zhenqing Shi. "Molecular fractionation of dissolved organic matter on ferrihydrite: effects of dissolved cations." Environmental Chemistry 16, no. 2 (2019): 137. http://dx.doi.org/10.1071/en18235.
Full textBotelho do Rego, A. M., Anna Maria Ferrari, M. Rei Vilar, J. El Beghdadi, and R. Naaman. "Molecular Adsorption on GaAs Studied by HREELS." Solid State Phenomena 99-100 (July 2004): 247–50. http://dx.doi.org/10.4028/www.scientific.net/ssp.99-100.247.
Full textLiu, Pingan, Junpeng Liu, and Mengjun Wang. "Adsorption of ethanol molecules on the Al (1 1 1) surface: a molecular dynamic study." Royal Society Open Science 6, no. 1 (January 2019): 181189. http://dx.doi.org/10.1098/rsos.181189.
Full textAvilova, Marta M., Ekaterina A. Mar'yeva, Olga V. Popova, and Tat'yana G. Ivanova. "MOLECULAR MODELING OF ADSORPTION OF POLLUTANT GASES ON CADMIUM-CONTAINING POLYACRYLONITRILE." IZVESTIYA VYSSHIKH UCHEBNYKH ZAVEDENII KHIMIYA KHIMICHESKAYA TEKHNOLOGIYA 63, no. 4 (April 16, 2020): 49–54. http://dx.doi.org/10.6060/ivkkt.20206304.6008.
Full textDU, HONGBO, ABIR DE SARKAR, YU JIA, and RUI-QIN ZHANG. "CHARACTERISTIC VIBRATIONAL MODES OF H2O ADSORBED MOLECULARLY AND DISSOCIATIVELY ON TITANIUM OXIDE CLUSTERS." Journal of Theoretical and Computational Chemistry 11, no. 06 (December 2012): 1289–95. http://dx.doi.org/10.1142/s0219633612500861.
Full textMohamed Ameen, Hiba, Sándor Kunsági-Máté, Péter Noveczky, Lajos Szente, and Beáta Lemli. "Adsorption of Sulfamethazine Drug onto the Modified Derivatives of Carbon Nanotubes at Different pH." Molecules 25, no. 11 (May 27, 2020): 2489. http://dx.doi.org/10.3390/molecules25112489.
Full textAfshari, Tooba, and Mohsen Mohsennia. "Transition metals doped ZnO nanocluster for ethylene oxide detection: A DFT study." Main Group Metal Chemistry 42, no. 1 (July 16, 2019): 113–20. http://dx.doi.org/10.1515/mgmc-2019-0012.
Full textYang, Siyuan, Linjiang Chen, Daniel Holden, Ruiyao Wang, Yuanyuan Cheng, Mona Wells, Andrew I. Cooper, and Lifeng Ding. "Understanding the effect of host flexibility on the adsorption of CH4, CO2 and SF6 in porous organic cages." Zeitschrift für Kristallographie - Crystalline Materials 234, no. 7-8 (July 26, 2019): 547–55. http://dx.doi.org/10.1515/zkri-2018-2150.
Full textWen, Zhihui, Yunpeng Yang, Qi Wang, and Banghua Yao. "Mechanism and Characteristics of CH4/CO2/H2O Adsorption in Lignite Molecules." Geofluids 2021 (March 20, 2021): 1–11. http://dx.doi.org/10.1155/2021/5535321.
Full textKopešťanský, Josef. "Reversible adsorption of hydrogen in adsorption-saturated acetylene layers on palladium surfaces." Collection of Czechoslovak Chemical Communications 50, no. 8 (1985): 1801–7. http://dx.doi.org/10.1135/cccc19851801.
Full textWalter, Wendy K., and Robert G. Jones. "1,2-dichloroethane adsorption on Cu(111): molecular adsorption." Surface Science 264, no. 3 (March 1992): 391–405. http://dx.doi.org/10.1016/0039-6028(92)90194-b.
Full textKong, Lingmei, Axel Enders, Talat S. Rahman, and Peter A. Dowben. "Molecular adsorption on graphene." Journal of Physics: Condensed Matter 26, no. 44 (October 7, 2014): 443001. http://dx.doi.org/10.1088/0953-8984/26/44/443001.
Full textAbbasi, Amirali, and Jaber Jahanbin Sardroodi. "Theoretical investigation of the adsorption behaviors of CO and CO2 molecules on the nitrogen-doped TiO2 anatase nanoparticles: Insights from DFT computations." Journal of Theoretical and Computational Chemistry 16, no. 01 (February 2017): 1750005. http://dx.doi.org/10.1142/s0219633617500055.
Full textZHENG, HAO, YONG XU, GUO-CAI DONG, JÖRG KRÖGER, and RICHARD BERNDT. "STRUCTURE OF A PHTHALOCYANINE DYE ON ZnO." Surface Review and Letters 26, no. 06 (July 2019): 1850204. http://dx.doi.org/10.1142/s0218625x18502049.
Full textLi, Danhui, Fengting Wang, Zhiyuan Zhang, Wanrun Jiang, Yu Zhu, Zhigang Wang, and Rui-Qin Zhang. "The nature of small molecules adsorbed on defective carbon nanotubes." Royal Society Open Science 6, no. 8 (August 2019): 190727. http://dx.doi.org/10.1098/rsos.190727.
Full textDing, Xue, Fu Yu Liu, and Chao He Yang. "Grand Canonical Monte Carlo Simulations of Olefins Adsorption in Zeolite ZSM-5." Advanced Materials Research 550-553 (July 2012): 321–24. http://dx.doi.org/10.4028/www.scientific.net/amr.550-553.321.
Full textPizzone, Mattia, Maria Grazia Grimaldi, Antonino La Magna, Neda Rahmani, Silvia Scalese, Jost Adam, and Rosaria A. Puglisi. "Study of the Molecule Adsorption Process during the Molecular Doping." Nanomaterials 11, no. 8 (July 24, 2021): 1899. http://dx.doi.org/10.3390/nano11081899.
Full textFujimoto, Yoshitaka. "Quantum transport, electronic properties and molecular adsorptions in graphene." Modern Physics Letters B 35, no. 08 (February 9, 2021): 2130001. http://dx.doi.org/10.1142/s0217984921300015.
Full textXu, Chenhong, Suqin Zhou, Jing Chen, Yuxiang Wang, and Lei He. "Adsorption mechanism of CO molecule on Al(111) surface: periodic DFT investigation." Canadian Journal of Chemistry 96, no. 12 (December 2018): 993–99. http://dx.doi.org/10.1139/cjc-2018-0169.
Full textNejad, Marjan A., and Herbert M. Urbassek. "Adsorption and Diffusion of Cisplatin Molecules in Nanoporous Materials: A Molecular Dynamics Study." Biomolecules 9, no. 5 (May 27, 2019): 204. http://dx.doi.org/10.3390/biom9050204.
Full textLu, Q., and G. Sorial. "Impact of pore size on competitive adsorption of phenolic compounds." Water Supply 4, no. 5-6 (December 1, 2004): 1–7. http://dx.doi.org/10.2166/ws.2004.0086.
Full textFilinchuk, Yaroslav, Nikolay Tumanov, Voraksmy Ban, Hyunchul Oh, Michael Hirscher, Bo Richter, Torben Jensen, et al. "Unprecedented adsorption of molecular hydrogen in the porous hydride framework." Acta Crystallographica Section A Foundations and Advances 70, a1 (August 5, 2014): C1473. http://dx.doi.org/10.1107/s205327331408526x.
Full textYang, Lilong, Xiang Zhou, Kewei Zhang, Fanhua Zeng, and Zhouhua Wang. "Investigation of dynamical properties of methane in slit-like quartz pores using molecular simulation." RSC Advances 8, no. 59 (2018): 33798–816. http://dx.doi.org/10.1039/c8ra06678g.
Full textVarghese, Seba Sara, Sundaram Swaminathan, Krishna Kumar Singh, and Vikas Mittal. "Molecular Oxygen Adsorbed on Gallium Doped Graphene: A First-Principles Study." Materials Science Forum 890 (March 2017): 117–20. http://dx.doi.org/10.4028/www.scientific.net/msf.890.117.
Full textRoldan, A., and N. H. de Leeuw. "Catalytic water dissociation by greigite Fe 3 S 4 surfaces: density functional theory study." Proceedings of the Royal Society A: Mathematical, Physical and Engineering Sciences 472, no. 2188 (April 2016): 20160080. http://dx.doi.org/10.1098/rspa.2016.0080.
Full textLipkowski, Jacek. "1998 Alcan Award Lecture Surface electrochemistry - surface science with a joy stick." Canadian Journal of Chemistry 77, no. 7 (July 1, 1999): 1163–76. http://dx.doi.org/10.1139/v99-124.
Full textQi, Chongchong, Lang Liu, Jianyong He, Qiusong Chen, Li-Juan Yu, and Pengfei Liu. "Understanding Cement Hydration of Cemented Paste Backfill: DFT Study of Water Adsorption on Tricalcium Silicate (111) Surface." Minerals 9, no. 4 (March 27, 2019): 202. http://dx.doi.org/10.3390/min9040202.
Full textTenner, M. G., E. W. Kuipers, A. W. Kleyn, and S. Stolte. "Steric effects in molecular adsorption." Journal of Chemical Physics 89, no. 10 (November 15, 1988): 6552–53. http://dx.doi.org/10.1063/1.455376.
Full textSteele, William. "Molecular interactions for physical adsorption." Chemical Reviews 93, no. 7 (November 1993): 2355–78. http://dx.doi.org/10.1021/cr00023a002.
Full textCai, H., A. C. Hillier, K. R. Franklin, C. C. Nunn, and M. D. Ward. "Nanoscale Imaging of Molecular Adsorption." Science 266, no. 5190 (December 2, 1994): 1551–55. http://dx.doi.org/10.1126/science.266.5190.1551.
Full textRisović, Dubravko. "Interfacial adsorption with molecular reorientation." Journal of Electroanalytical Chemistry 588, no. 1 (March 2006): 122–28. http://dx.doi.org/10.1016/j.jelechem.2005.12.018.
Full textKaneko, Katsumi, Tomonori Ohba, Takahiro Ohkubo, Shigenori Utsumi, Hironobu Kanoh, Masako Yudasaka, and Sumio Iijima. "Nanospace Molecular Science and Adsorption." Adsorption 11, S1 (July 2005): 21–28. http://dx.doi.org/10.1007/s10450-005-5893-8.
Full textLipkowski, J., L. Stolberg, D. F. Yang, B. Pettinger, S. Mirwald, F. Henglein, and D. M. Kolb. "Molecular adsorption at metal electrodes." Electrochimica Acta 39, no. 8-9 (June 1994): 1045–56. http://dx.doi.org/10.1016/0013-4686(94)e0019-v.
Full textAl-Zaid, Khairya, Saed Akashah, Fathi Owaysi, G. V. Jeffreys, Yu A. Eltekov, and C. Mumford. "Adsorption of Aromatic Compounds from Solutions on Molecular Sieve 13X." Adsorption Science & Technology 4, no. 3 (September 1987): 196–210. http://dx.doi.org/10.1177/026361748700400305.
Full textZhao, Yi, Han Wang, and Tianhao Wang. "Preparation of molecularly imprinted adsorbents and NO adsorption property." Functional Materials Letters 10, no. 02 (April 2017): 1650070. http://dx.doi.org/10.1142/s1793604716500703.
Full textXu, Long, Ze-Xin Zhao, Yun-An Huang, and Qiu-Jin Zhu. "Preparation of Chitosan Molecularly Imprinted Polymers and the Recognition Mechanism for Adsorption of Alpha-Lipoic Acid." Molecules 25, no. 2 (January 13, 2020): 312. http://dx.doi.org/10.3390/molecules25020312.
Full textGalvez-Martinez, Santos, and Eva Mateo-Marti. "Ultraviolet Irradiation on a Pyrite Surface Improves Triglycine Adsorption." Life 8, no. 4 (October 25, 2018): 50. http://dx.doi.org/10.3390/life8040050.
Full textUlfa, Maria, and Farhah Nayla Fawzia. "Study of Adsorption Capacity of Dibenzotiofen Molecules on Mesoporous Carbon with Pore Geometry Model." JKPK (Jurnal Kimia dan Pendidikan Kimia) 2, no. 2 (September 7, 2017): 110. http://dx.doi.org/10.20961/jkpk.v2i2.11908.
Full textTsapatsis, Michael, and George R. Gavalas. "Synthesis of Porous Inorganic Membranes." MRS Bulletin 24, no. 3 (March 1999): 30–35. http://dx.doi.org/10.1557/s0883769400051885.
Full textLiu, Guangzeng, Shenhao Chen, Ma Hongfang, and Xiuyu Liu. "Molecular simulation study of 1,5-diphenylcarbazide self-assembled monolayers on a copper surface." Journal of the Serbian Chemical Society 72, no. 5 (2007): 475–84. http://dx.doi.org/10.2298/jsc0705475l.
Full textDu, Xiaoming. "Molecular Simulation of Hydrogen Storage in Ion-Exchanged X Zeolites." Advances in Materials Science and Engineering 2014 (2014): 1–10. http://dx.doi.org/10.1155/2014/189745.
Full textCárdenas, Harry, and Erich Müller. "Molecular Simulation of the Adsorption and Diffusion in Cylindrical Nanopores: Effect of Shape and Fluid–Solid Interactions." Molecules 24, no. 3 (February 9, 2019): 608. http://dx.doi.org/10.3390/molecules24030608.
Full textJakšić, Olga, Marko Spasenović, Zoran Jakšić, and Dana Vasiljević-Radović. "Monolayer Gas Adsorption on Graphene-Based Materials: Surface Density of Adsorption Sites and Adsorption Capacity." Surfaces 3, no. 3 (August 24, 2020): 423–32. http://dx.doi.org/10.3390/surfaces3030031.
Full textMasas, Daria S., Maria S. Ivanova, Gocha Sh Gogelashvili, Alexander S. Maslennikov, Yury B. Grunin, and Tatiana Yu Grunina. "Analysis of water state adsorbed by cellulose fibers." Butlerov Communications 58, no. 5 (May 31, 2019): 24–31. http://dx.doi.org/10.37952/roi-jbc-01/19-58-5-24.
Full textZhu, Sheng-Bai. "Theoretical Study of Molecular Contamination on Silicon Wafers: Kinetics." Journal of the IEST 41, no. 5 (September 14, 1998): 36–43. http://dx.doi.org/10.17764/jiet.41.5.y28564q840587783.
Full textWEGNER, H., K. WEISS, and CH WÖLL. "FORMATION OF ORDERED MOLECULAR OVERLAYERS BY A TEMPERATURE-INDUCED SURFACE REACTION: HEXABUTYLOXYTRIPHENYLENE ON Cu(111)." Surface Review and Letters 06, no. 02 (April 1999): 183–92. http://dx.doi.org/10.1142/s0218625x99000214.
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