Allowable stretching bond force constants on carbon nanomaterials: A DFT study (English)
- New search for: Medina, J.
- New search for: Cab, C.
- New search for: Casais-Molina, M.L.
- New search for: Medina-Esquivel, R.A.
- New search for: Canto, G.
- New search for: Tapia, A.
- New search for: Medina, J.
- New search for: Cab, C.
- New search for: Casais-Molina, M.L.
- New search for: Medina-Esquivel, R.A.
- New search for: Canto, G.
- New search for: Tapia, A.
In:
Diamond and Related Materials
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126
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2022
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ISSN:
- Article (Journal) / Electronic Resource
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Title:Allowable stretching bond force constants on carbon nanomaterials: A DFT study
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Contributors:Medina, J. ( author ) / Cab, C. ( author ) / Casais-Molina, M.L. ( author ) / Medina-Esquivel, R.A. ( author ) / Canto, G. ( author ) / Tapia, A. ( author )
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Published in:
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Publisher:
- New search for: Elsevier B.V.
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Publication date:2022-05-01
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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 126
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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Carbon spheres with high photothermal conversion efficiency for photothermal therapy of tumorWei, Chengxiong / Jin, Xin / Wu, Chengwei / Brozovic, Anamaria / Zhang, Wei et al. | 2022
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Biomass carbon materials with porous array structures derived from soybean dregs for effective electromagnetic wave absorptionYue, Jing / Yu, Jiaqi / Jiang, Shaohua / Chen, Yiming et al. | 2022
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Efficient degradation of emerging organic pollutant by cerium phosphate/g-C3N4/Vis/PMS system: Catalytic kinetics and toxicity evaluationJustinabraham, Romiyo / Durairaj, Arulappan / Ramanathan, Subramanian / Padmanabhan, Dhanasekaran / Wesley, Ramachandran John / Obadiah, Asir / Lv, Xiaomeng / Ramasundaram, Subramaniyan / Vasanthkumar, Samuel et al. | 2022
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N and S co-doped 3D hierarchical porous carbon as high-performance electrode material for supercapacitorsNing, Ke / Zhao, Guangzhen / Liu, Hanxiao / Hu, Mingzhu / Huang, Fei / Li, Hengzheng / Zhang, Li / Zhu, Guang / Wang, Hongyan / Shi, Junyou et al. | 2022
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Study of the influence of palladium nanoparticles on the structure of DLC films synthesized on silicon (100) substratesRyaguzov, A.P. / Assembayeva, A.R. / Myrzabekova, M.M. / Nemkayeva, R.R. / Guseinov, N.R. et al. | 2022
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Theoretical assessment of the solvent effect on the functionalization of Au32 and C60 nanocages with fluorouracil drugSabet, Mahsa / Tanreh, Sepideh / Khosravi, Arezoo / Astaraki, Mohammad / Rezvani, Mahyar / Darvish Ganji, Masoud et al. | 2022
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Electromagnetic and microwave absorption properties of Ag wrapped MXene composite with frequency selective surface incorporationLiu, Yi / Qin, Jingnan / Shi, Haohao / Xu, Jie / Lu, Linlin / Su, Xiaolei et al. | 2022
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Nanocomposite electrodes using highly conductive sub-millimetre-long single-walled carbon nanotubes pasted with PEDOT:PSS and high-performance actuatorsTerasawa, Naohiro et al. | 2022
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Synthesis of super-hydrophobic and self-cleaning magnetic graphene aerogel with excellent microwave absorption propertiesXu, Dongwei / Ren, Yumei / Guo, Xiaoqin / Feng, Desheng / Yang, Run / Zhao, Biao / Zhang, Rui et al. | 2022
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Localized vibrational modes of GeV-centers in diamond: Photoluminescence and first-principles phonon studyBoldyrev, Kirill N. / Sedov, Vadim S. / Vanpoucke, Danny E.P. / Ralchenko, Victor G. / Mavrin, Boris N. et al. | 2022
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Improving tribological performance of porous oil-impregnated GO/PA6 composites with double lubrication structureZhang, Ying / Liu, Haoran / Zhou, Shaofeng / Huang, Jin / Zhao, Guizhe / Liu, Yaqing et al. | 2022
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Biomass-derived S, P, Cl tri-doped porous carbon for high-performance supercapacitorZhang, Li / Wang, Youyun / Yang, Shengwang / Zhao, Guangzhen / Han, Lu / Li, Yanjiang / Zhu, Guang et al. | 2022
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Interaction of free-base and 3d metal(II) phthalocyanines with open-shell endohedral fullerenes species N@C60 and P@C60Tahuilan-Anguiano, Diana E. / Basiuk, Vladimir A. et al. | 2022
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Unusual re-entrant spin-glass-behavior and enhanced diamagnetism in sp3-rich sulfur/oxygen doped highly oriented pyrolytic graphiteWu, Hansong / Li, Wenkang / Dai, Yixin / Li, Wenxue / Guo, Jian / Song, Jiaxin / Wang, Shanling / He, Yi / Gu, Aiqun / Wen, Jiqiu et al. | 2022
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Molecular structure effects of mesophase pitch and isotropic pitch on morphology and properties of carbon nanofibers by electrospinningZhang, Jiahui / Qi, Yong / Yang, Jianxiao / Shi, Kui / Li, Jun / Zhang, Xiaxiang et al. | 2022
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Hydrogen implantation-induced blistering in diamond: Toward diamond layer transfer by the Smart Cut™ techniqueMasante, C. / de Vecchy, J. / Mazen, F. / Milesi, F. / Di Cioccio, L. / Pernot, J. / Lloret, F. / Araujo, D. / Pinero, J.C. / Rochat, N. et al. | 2022
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From waste to wealth: Crumb rubber@carbon nanotube/Fe3O4 composites towards highly effective electromagnetic microwave absorption with wide bandwidthZheng, Jiajia / Hanshe, Mohammed / Sun, Zhaoxu / Chen, Yiming / Jiang, Shaohua / Zhang, Yixuan / Cao, Yuxuan / Li, Xiping / E, Shiju et al. | 2022
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A new sensitive electrochemical sensor based on BiVO4/ZrO2@graphene modified GCE for concurrent sensing of acetaminophen, phenylephrine hydrochloride and cytosine in medications and human serum samplesMurugan, E. / Poongan, A. et al. | 2022
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Simultaneously achieving narrowband and broadband light absorption enhancement in monolayer grapheneYan, Zhendong / Gao, Lei / Tang, Chaojun / Lv, Bin / Gu, Ping / Chen, Jing / Zhu, Mingwei et al. | 2022
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Electromechanical response of stacked h-BN layers: A computational studyChoyal, V.K. / Kundalwal, S.I. et al. | 2022
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Facile construction of low-cost and high-efficiency microwave absorbent of Co/C/CG composite with dual-enhancement performanceWang, Yake / Liang, Liping / Li, Yuyan / Liu, Cuirong / Wu, Zhisheng / Li, Guomin / Tian, Yuming / Zhu, Baoshun et al. | 2022
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The kinetics of crack propagation in CVD graphene filmGuo, Zi / Li, Chengda / Zu, Pengjiao / Liu, Ze / Li, Jun / Li, Jia et al. | 2022
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Facile construction of N-doped porous carbon nanosheets derived from melamine cyanurate/xylitol for advanced sodium-ion batteriesNi, Xuepeng / Li, Kunming / Li, Dong / Wu, Qianqian / Chen, Haoyu / Li, Jie / Chen, Huifang / Wu, Qilin / Ju, Anqi et al. | 2022
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New chemical pathway for large-area deposition of doped diamond films by linear antenna microwave plasma chemical vapor depositionMarton, Marián / Vojs, Marian / Michniak, Pavol / Behúl, Miroslav / Rehacek, Vlastimil / Pifko, Michal / Stehlík, Štěpán / Kromka, Alexander et al. | 2022
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Reduction of graphene oxide using Salvia Officinalis plant extract and its utilization for LiO2 batteriesAl-Ogaili, Ahmed Waleed Majeed / Pakseresht, Sara / Cetinkaya, Tugrul / Akbulut, Hatem et al. | 2022
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Role of grain boundary and nanoholes in geometrical deformation and bonding energies of graphene/hexagonal boron nitrideFan, Lei / Bian, Zuguang / Huang, Zhuye / Xia, Yongqiang / Song, Fangyuan / Xu, Jin et al. | 2022
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Fluorescent carbon quantum dots as a novel solution and paper strip-based dual sensor for the selective detection of Cr(VI) ionsJohn, Bony K. / John, Neenamol / Mathew, Sneha / Korah, Binila K. / Punnoose, Mamatha Susan / Mathew, Beena et al. | 2022
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Study on the microstructure and mechanical properties of reactive plasma sprayed TiCxN1−x composite coatings with different Ti/graphite powdersQin, Yanfang / He, Zhihua / Zhao, Hongjian / Song, Jinsong / Lu, Jinbin / Ma, Zhenwu / He, Jining et al. | 2022
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Effect of defects and boundary conditions on the vibrational behavior of carbon nanotube and graphene: A molecular dynamics perspectiveBedi, Deepa / Sharma, Sumit / Tiwari, S.K. / Ajori, Shahram et al. | 2022
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Biomass derived porous carbon supported nano-Co3O4 composite for high-performance supercapacitorsZou, Ruyi / Wang, Baoli / Zhu, Lin / Yan, Lijun / Shi, Fan / Sun, Yunxiu / Shao, Bo / Zhang, Siyue / Sun, Wei et al. | 2022
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Microwave irradiation spectrum of graphene oxide paper regulated by Na ionsJiang, Wenshuai / Wang, Shumin / Lin, Fei / Li, Zhenxin / Tian, Xiang / Ti, Ruixia / Zhang, Chaoxin / Wang, Shaozhe / Zhao, Guoan / Ren, Wu et al. | 2022
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Physiochemical evaluations, mechanical attenuations and thermal stability of graphene nanosheets and functionalized nanodiamonds loaded pitch derived carbon foam compositesKhan, Muhammad / Tiehu, Li / Hussain, Amjad / Raza, Ali / Zada, Amir / Alei, Dang / Khan, Ahsan Riaz / Ali, Rawaid / Hussain, Hidayat / Hussain, Javid et al. | 2022
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Superamphiphobic properties of fluorine doped graphene prepared by RF-PECVD: EIS and first principle studyYuling, Lu / Dayu, Li et al. | 2022
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Fabrication of nanostructured DLC coatings using anodic alumina filmsNakamura, Masashi / Kuno, Shingo / Hayashi, Minoru / Asoh, Hidetaka et al. | 2022
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A DFT study of adsorption properties of SO2, SOF2, and SO2F2 on ZnO/CuO doped grapheneXu, Pan / Gui, Yingang / Chen, Xianping et al. | 2022
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Adsorption of yttrium bisphthalocyanine on pristine and defect-contaning graphene models: A DFT studyMendoza-Domínguez, Carlos Uriel / Basiuk, Vladimir A. et al. | 2022
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Synthesizing N-[4-morpholinecarboximidamidoyl]carboximidamidoylated graphene oxide for fabricating high-sensitive humidity sensorsShen, Qian-Qian / Zhang, Chao-Zhi / Bai, Yuan / Ni, Meng-Ran et al. | 2022
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Sublayer material as a critical factor of piezoelectric response in nitrogen-doped carbon nanotubesIl'ina, Marina V. / Osotova, Olga I. / Rudyk, Nikolay N. / Khubezhov, Soslan A. / Pankov, Ilya V. / Ageev, Oleg A. / Il'in, Oleg I. et al. | 2022
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High-temperature annealing of polycrystalline diamond compact with cobalt removal and evolution of tribological properties of grinding ballsLuo, Xun / Gou, Ruyi / Li, Kunyao / Kang, Chenchen / Chen, Jingjing / Kang, Guirong et al. | 2022
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Structural, electronic and optical properties of AB bilayer graphene intercalated by Sr atom: A first principles studyFarkad, O. / Takassa, R. / Elfatouaki, F. / Hassine, S. / Ijdiyaou, Y. / Ibnouelghazi, E.A. / Abouelaoualim, D. et al. | 2022
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Pseudo-vertical Mo/Au Schottky diodes on {113} oriented boron doped homoepitaxial diamond layersHazdra, P. / Laposa, A. / Šobáň, Z. / Taylor, A. / Lambert, N. / Povolný, V. / Kroutil, J. / Gedeonová, Z. / Hubík, P. / Mortet, V. et al. | 2022
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Evaluation of graphitization and tensile property in microwave plasma treated carbon fiberWei, Xinyu / Zhang, Wenjin / Chen, Longwei / Xia, Xulu / Meng, Yuedong / Liu, Chengzhou / Lin, Qifu / Jiang, Yiman / Gao, Shengtao et al. | 2022
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Hydroxyapatite-based bio-ceramic of ternary nanocomposites containing cuprous oxide/graphene oxide for biomedical applicationsEldrehmy, E.H. / Alghamdi, Y.S. / Amer, H.H. / Yassin, M.H. / Mostafa, S.A. / Moustapha, Moustapha Eid / Menazea, A.A. et al. | 2022
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Complete analysis of dislocations in single crystal diamondsSato, Y. / Miyajima, K. / Shikata, S. et al. | 2022
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Carbon soot nanoparticles derived from wasted rubber: An additive in lubricating oil for efficient friction and wear reductionNowduru, Ravikiran / Bodapati, Bolla Reddy / Penumakala, Pavan Kumar / Malladi, Sai Ram Krishna / Jain, Pawan Kumar / Srikanth, Vadali Venkata Satya Siva et al. | 2022
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Allowable stretching bond force constants on carbon nanomaterials: A DFT studyMedina, J. / Cab, C. / Casais-Molina, M.L. / Medina-Esquivel, R.A. / Canto, G. / Tapia, A. et al. | 2022
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