Relevant bibliographies by topics / Amorphous Carbon

Academic literature on the topic 'Amorphous Carbon'

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Published: 4 June 2021
Last updated: 7 September 2023

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Journal articles on the topic "Amorphous Carbon"

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Robertson, J. "Amorphous carbon." Advances in Physics 35, no. 4 (January 1986): 317–74. http://dx.doi.org/10.1080/00018738600101911.

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Robertson, John. "Amorphous carbon." Current Opinion in Solid State and Materials Science 1, no. 4 (August 1996): 557–61. http://dx.doi.org/10.1016/s1359-0286(96)80072-6.

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Best, Steven, Jake B. Wasley, Carla de Tomas, Alireza Aghajamali, Irene Suarez-Martinez, and Nigel A. Marks. "Evidence for Glass Behavior in Amorphous Carbon." C — Journal of Carbon Research 6, no. 3 (July 30, 2020): 50. http://dx.doi.org/10.3390/c6030050.

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Amorphous carbons are disordered carbons with densities of circa 1.9–3.1 g/cc and a mixture of sp2 and sp3 hybridization. Using molecular dynamics simulations, we simulate diffusion in amorphous carbons at different densities and temperatures to investigate the transition between amorphous carbon and the liquid state. Arrhenius plots of the self-diffusion coefficient clearly demonstrate that there is a glass transition rather than a melting point. We consider five common carbon potentials (Tersoff, REBO-II, AIREBO, ReaxFF and EDIP) and all exhibit a glass transition. Although the glass-transition temperature (Tg) is not significantly affected by density, the choice of potential can vary Tg by up to 40%. Our results suggest that amorphous carbon should be interpreted as a glass rather than a solid.
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Dasgupta, D., F. Demichelis, and A. Tagliaferro. "Electrical conductivity of amorphous carbon and amorphous hydrogenated carbon." Philosophical Magazine B 63, no. 6 (June 1991): 1255–66. http://dx.doi.org/10.1080/13642819108205558.

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Orofino, V., L. Colangeli, E. Bussoletti, and F. Strafella. "Amorphous carbon around carbon stars." Astrophysics and Space Science 138, no. 1 (1987): 127–40. http://dx.doi.org/10.1007/bf00642871.

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Bussoletti, E., L. Colangeli, and V. Orofino. "Interstellar amorphous carbon." Astrophysical Journal 321 (October 1987): L87. http://dx.doi.org/10.1086/185011.

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Kakinuma, H., H. Fukuda, S. Nishikawa, T. Watanabe, and K. Nihei. "Amorphous carbon coating on amorphous silicon photoreceptors." Journal of Applied Physics 61, no. 9 (May 1987): 4679–81. http://dx.doi.org/10.1063/1.338379.

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Yastrebov, S. G., V. I. Ivanov-Omskii, V. I. Siklitsky, and A. A. Sitnikova. "Carbon clusters in amorphous hydrogenated carbon." Journal of Non-Crystalline Solids 227-230 (May 1998): 622–26. http://dx.doi.org/10.1016/s0022-3093(98)00141-0.

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Han, Z. J., B. K. Tay, M. Shakerzadeh, and K. Ostrikov. "Superhydrophobic amorphous carbon/carbon nanotube nanocomposites." Applied Physics Letters 94, no. 22 (June 2009): 223106. http://dx.doi.org/10.1063/1.3148667.

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Falk, Michael. "Amorphous solid carbon dioxide." Journal of Chemical Physics 86, no. 2 (January 15, 1987): 560–64. http://dx.doi.org/10.1063/1.452307.

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Dissertations / Theses on the topic "Amorphous Carbon"

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Kleinsorge, Britta Yvonne. "Doping of amorphous carbon." Thesis, University of Cambridge, 2000. http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.621744.

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Ferrari, Andrea Carlo. "Nanoscale properties of amorphous carbon." Thesis, University of Cambridge, 2001. http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.621037.

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Satyanarayana, Bukinakere Subbakrishniah. "Field emission from tetrahedral amorphous carbon." Thesis, University of Cambridge, 2000. http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.621638.

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Jones, Todd J. Tombrello Thomas A. "Radiation-induced conductivity in amorphous carbon /." Diss., Pasadena, Calif. : California Institute of Technology, 1989. http://resolver.caltech.edu/CaltechETD:etd-02022007-131335.

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Walters, Jennifer. "The structure of amorphous hydrogenated carbon." Thesis, University of Kent, 1995. https://kar.kent.ac.uk/38837/.

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The structure of several amorphous hydrogenated carbon (a-C:H) samples has been studied in detail using time-of-flight neutron diffraction, inelastic neutron scattering, infrared spectroscopy and reverse Monte Carlo (RMC) computer modelling. Supplementary work has also included combustion analysis. The results are presented as evidence for a new structural model for a-C:H. The high-resolution real-space neutron diffraction data allows direct determination of the single:double bond ratio, and also shows the presence of sp1 hybridised carbon bonding environments in some samples. There is limited evidence for the presence of molecular hydrogen "trapped" within the amorphous network. The spectroscopic data is then used to provide information on the C-H bonding environments, so that using a combination of experimental techniques a detailed picture of the atomic scale structure has been produced. For the hand carbon samples, prepared using acetylene and propane, the carbon-atom sites are found to be predominantly sp2 bonded, with a single:double bond ratio for carbon-carbon bonds of about 2.5:1. The effect of beam energy on the structure of the material is also investigated, and comparison made between samples prepared using a fats-atom (neutral particle)source and those prepared by plasma enhanced chemical vapour deposition, from acetylene. The results show that in both deposition methods, increasing the beam energy produces a lower total sp2 hybridised carbon content in the material with evidence for a shift from pure olefinic to some aromatic/graphitic bonding in one sample. This trend to a more aromatic bonding environment is also observed in samples prepared from a cyclohexane precursor. The spectroscopy results show that for all samples the hydrogen bonding environments are similar, although there is some evidence for changes in the distribution of hydrogen within the network with deposition energy. The spectra for all the samples show similarities to those for the polymeric materials, polyethylene and rubber. In addition, the results of a study of the structure of a-C:H up to a maximum of 1000c are presented. The data show clearly the effect on atomic correlations of elevated temperatures, with the initial room-temperature amorphous network (a mixture of single bonds and olefinic double bonds) becoming progressively aromatic, the graphite as hydrogen is evolved. Infrared spectroscopy results would seem to indicate that sp3 CH is the primary source of hydrogen for effusion, such that, on annealing, molecular hydrogen is formed wherever there are two neighboring hydrogen atoms. Structural transformations are seen to occur throughout the heating process. Finally, the RMC method has been used to produce a model for the structure of a-C:H, by fitting to experimental data from neutron and X-ray diffraction experiments. The RMC method was implemented with the introduction of additional constraints on the minimum number of atoms in a ring, and on the maximum coordination number. Once the data has been fitted, it is possible to generate model partial pair distribution functions, bond angle distributions, coordination number distributions, etc. By fitting all the experimental data sets simultaneously, there is sufficient information to generate a viable "physical" model for the structure of these materials. The effects of increasing number density within the model have also been investigated, and this confirmed that the density is a crucial parameter in the modelling process.
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Honeybone, P. J. R. "Neutron scattering studies of amorphous hydrogenated carbon and silcon carbon." Thesis, University of Kent, 1992. http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.317306.

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TASAYCO, CARLOS MANUEL SANCHEZ. "NITROGEN INCORPORATION INTO AMORPHOUS FLUORINATED CARBON FILMS." PONTIFÍCIA UNIVERSIDADE CATÓLICA DO RIO DE JANEIRO, 2003. http://www.maxwell.vrac.puc-rio.br/Busca_etds.php?strSecao=resultado&nrSeq=3698@1.

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CONSELHO NACIONAL DE DESENVOLVIMENTO CIENTÍFICO E TECNOLÓGICO
As propriedades tribológicas de revestimentos de carbono usados em discos rígidos magnéticos foram de enorme importância para o contínuo aumento da densidade de informação armazenada nos mesmos. As características mecânicas e estruturais de filmes de carbono amorfo também foram indispensáveis para o desenvolvimento de revestimentos que atendessem às especificações do desenvolvimento destes dispositivos: alta dureza e densidade, além de baixo coeficiente de atrito e alta resistência ao desgaste. Neste trabalho são apresentados os efeitos da incorporação de nitrogênio em filmes de carbono fluorado (a-C:H:F) depositados pela técnica de deposição por vapor químico assistido por plasma. As propriedades mecânicas e estruturais foram investigadas com o uso das técnicas nucleares (retroespalhamento Rutherford, detecção de recuo elástico, reação nuclear), espectroscopia de fotoelétrons induzidos por raios-X, medidas de tensão interna (por perfilometria), espectroscopia de absorção no infravermelho, espectroscopia Raman, microscopia de força atômica e medidas de ângulo de contato. Foi depositada uma série de filmes onde foi variada a pressão de N2 em uma atmosfera precursora de CH4-CF4 (1:2) (PN2 = 0% até 60%). A tensão de autopolarização foi fixada em - 350V. Os resultados obtidos mostram que as propriedades dos filmes são controladas pela incorporação de nitrogênio que chega a 20 at.%. Identificou-se um decaimento na taxa de deposição com o incremento da pressão parcial de N2, e um sensível decaimento na concentração de flúor. O filme fica menos tensionado, o que pode resultar em uma melhoria na adesão. Entretanto, o ângulo de contato diminui, resultando em um aumento no coeficiente de atrito. Novos estudos procurando aumentar simultaneamente as concentrações de F e N são sugeridos.
The tribological properties of carbon coatings of hard magnetic disks played an important role for the continuous increase of their storage capacity. The mechanical and structural properties were also important: high density, hardness and wear resistance, and low friction coefficient. In this work, we study the effects of the nitrogen incorporation into fluorinated carbon films (a-C:H:F) deposited by plasma enhanced chemical vapor deposition. The film properties were investigated by using a multitechnique approach: nuclear techniques (Rutherford backscattering, elastic recoil and nuclear reaction analyses), x-ray photoelectron spectroscopy, internal stress measurements by perfilometry, Raman and Infrared spectroscopies, atomic force microscopy and contact angle measurements. Films were deposited changing the N2 partial pressure in a precursor atmosphere also composed by a fixed CH4-CF4 mixture (1:2) (PN2: 0 - 60%), with the self-bias voltage of -350V. The results show that the film properties are controlled by the nitrogen incorporation, with an important fluorine content reduction. The internal stress reduction may result in an increase of the film adhesion. However, the contact angle decreases upon nitrogen incorporation, resulting in an increase of the friction coefficient. New studies with the goal of obtain a simultaneous increase of both fluorine and nitrogen content are suggested.
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Miriyala, Nikhila. "Porous carbon carriers for amorphous drug delivery." Thesis, Aston University, 2018. http://publications.aston.ac.uk/37526/.

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Given the great potential of porous carrier based drug delivery for stabilising the amorphous form of drugs and enhancing dissolution profiles, this thesis centred on investigations into the application of activated carbon (AC) and carbon onion (OLC) as porous carriers for oral delivery, using paracetamol (PA) and ibuprofen (IBU) as model drugs. Initial work was focussed on the toxicity studies of AC followed by preparation and characterisation of drug/AC complex. Results showed that AC is a promising drug carrier with low toxicity, high loading capacity and ability to stabilise amorphous drug. However, loading efficiency and solid state characteristics were different for PA and IBU, whilst the drug release from AC was incomplete in the absence of surfactant. To investigate the factors affecting drug loading, three different loading methods were compared, with solution adsorption followed by centrifugation found to be the optimum method to achieve maximum loading with least crystallinity. Initial drug concentration in the loading solution was also found to influence the loading, where the optimum concentration to achieve maximum loading without any crystallinity differed depending on the chemical nature of the drug. Further, the surface chemistry of AC was modified in order to achieve complete drug release, and results showed that drug release increased with an increase in the surface oxygen content of AC. Also, drug release was found to increase with a decrease in the micropore volume fraction. The second part of the work was focussed on the synthesis and characterisation of OLC, followed by drug loading studies. Results showed that annealing of nano-diamonds (ND) at 1100 oC produced OLC with a diamond core, which is non-toxic. Drug loading studies revealed that loadings achieved were lower than those seen with AC, regardless of drug solubility. Of the both carriers investigated, AC was less expensive and found to be a promising carrier with higher loading capacity and lower toxicity.
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Tsai, Tsung Hui. "Tetrahedral amorphous carbon based field emission display." Thesis, University of Cambridge, 2002. http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.620674.

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Piscanec, Stefano. "Raman spectra of graphite, carbon nanotubes, silicon nanowires and amorphous carbon." Thesis, University of Cambridge, 2006. http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.614290.

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Books on the topic "Amorphous Carbon"

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Silva, S. R. P. Properties of amorphous carbon. London: IEE, 2003.

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Schultrich, Bernd. Tetrahedrally Bonded Amorphous Carbon Films I. Berlin, Heidelberg: Springer Berlin Heidelberg, 2018. http://dx.doi.org/10.1007/978-3-662-55927-7.

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J, Pouch John, and Alterovitz Samuel A, eds. Properties and characterization of amorphous carbon films. Aedermannsdorf, Switzerland: Trans Tech Publication, 1990.

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Wächter, Rolf. Deposition and characterisation of amorphous hydrogenated carbon films. Oxford: Oxford Brookes University, 1999.

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Tsai, Kun Chao. Investigation of micro-mechanical applications of amorphous carbon films. [s.l: The Author], 2003.

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Alterovitz, Samuel A. Rapid thermal annealing of amorphous hydrogenated carbon (a-C:H) films. [Washington, D.C.]: National Aeronautics and Space Administration, 1987.

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Miyoshi, Kazuhisa. Plasma-deposited amorphous hydrogenated carbon films and their tribological properties. Cleveland, Ohio: Lewis Research Center, 1989.

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Miyoshi, Kazuhisa. Plasma-deposited amorphous hydrogenated carbon films and their tribological properties. Cleveland, Ohio: Lewis Research Center, 1989.

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Miyoshi, Kazuhisa. Plasma-deposited amorphous hydrogenated carbon films and their tribological properties. Cleveland, Ohio: Lewis Research Center, 1989.

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P, Koidl, Oelhafen P, Council of Europe, Commission of the European Communities., and E-MRS Symposium on Amorphous Hydrogenated Carbon Films (1987 : Strasbourg, France), eds. Amorphous hydrogenated carbon films: June 2nd-5th 1987, Strasbourg, France. Les Ulis, France: Les Editions de Physique, 1987.

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Book chapters on the topic "Amorphous Carbon"

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Kouchi, Akira. "Amorphous Carbon." In Encyclopedia of Astrobiology, 1–2. Berlin, Heidelberg: Springer Berlin Heidelberg, 2014. http://dx.doi.org/10.1007/978-3-642-27833-4_70-2.

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Kouchi, Akira. "Amorphous Carbon." In Encyclopedia of Astrobiology, 88–89. Berlin, Heidelberg: Springer Berlin Heidelberg, 2015. http://dx.doi.org/10.1007/978-3-662-44185-5_70.

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Kouchi, Akira. "Amorphous Carbon." In Encyclopedia of Astrobiology, 41–42. Berlin, Heidelberg: Springer Berlin Heidelberg, 2011. http://dx.doi.org/10.1007/978-3-642-11274-4_70.

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Kouchi, Akira. "Amorphous Carbon." In Encyclopedia of Astrobiology, 109–10. Berlin, Heidelberg: Springer Berlin Heidelberg, 2023. http://dx.doi.org/10.1007/978-3-662-65093-6_70.

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Martinu, Ludvik. "Amorphous Carbon Films." In High Energy Density Technologies in Materials Science, 77–87. Dordrecht: Springer Netherlands, 1990. http://dx.doi.org/10.1007/978-94-009-0499-6_6.

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Irvine, William M. "Hydrogenated Amorphous Carbon." In Encyclopedia of Astrobiology, 1. Berlin, Heidelberg: Springer Berlin Heidelberg, 2014. http://dx.doi.org/10.1007/978-3-642-27833-4_755-3.

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Irvine, William M. "Hydrogenated Amorphous Carbon." In Encyclopedia of Astrobiology, 1151. Berlin, Heidelberg: Springer Berlin Heidelberg, 2015. http://dx.doi.org/10.1007/978-3-662-44185-5_755.

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Irvine, William M. "Hydrogenated Amorphous Carbon." In Encyclopedia of Astrobiology, 784. Berlin, Heidelberg: Springer Berlin Heidelberg, 2011. http://dx.doi.org/10.1007/978-3-642-11274-4_755.

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Schultrich, Bernd. "Amorphous Carbon Films." In Tetrahedrally Bonded Amorphous Carbon Films I, 105–10. Berlin, Heidelberg: Springer Berlin Heidelberg, 2018. http://dx.doi.org/10.1007/978-3-662-55927-7_4.

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Irvine, William M. "Hydrogenated Amorphous Carbon." In Encyclopedia of Astrobiology, 1380. Berlin, Heidelberg: Springer Berlin Heidelberg, 2023. http://dx.doi.org/10.1007/978-3-662-65093-6_755.

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Conference papers on the topic "Amorphous Carbon"

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Ledrappier, F., L. Houze, and C. Heau. "A Comparison of the Tribology of Tetrahedral Amorphous Carbon and Hydrogenated Amorphous Carbon." In SAE World Congress & Exhibition. 400 Commonwealth Drive, Warrendale, PA, United States: SAE International, 2008. http://dx.doi.org/10.4271/2008-01-1466.

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SILVA, SRP, J. ROBERTSON, W. I. MILNE, and G. A. J. AMARATUNGA. "AMORPHOUS CARBON: State Of The Art." In Proceedings of the 1st International Specialist Meeting on Amorphous Carbon (SMAC '97). WORLD SCIENTIFIC, 1998. http://dx.doi.org/10.1142/9789814528658.

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Ali, Mokhtar, G. Venkata Ramana, Balaji Padya, V. V. S. S. Srikanth, and P. K. Jain. "Synthesis of amorphous carbon nanofibers using iron nanoparticles as catalysts." In CARBON MATERIALS 2012 (CCM12): Carbon Materials for Energy Harvesting, Environment, Nanoscience and Technology. AIP, 2013. http://dx.doi.org/10.1063/1.4810064.

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HUFF, R. G., F. V. DIMARCELLO, and A. C. HART, JR. "Amorphous carbon hermetically coated optical fibers." In Optical Fiber Communication Conference. Washington, D.C.: OSA, 1988. http://dx.doi.org/10.1364/ofc.1988.tug2.

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Pellman, Mark A. "Tetrahedral Amorphous Carbon for Piston Rings." In 64th Society of Vacuum Coaters Annual Technical Conference. Society of Vacuum Coaters, 2021. http://dx.doi.org/10.14332/svc21.proc.0057.

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Huang, Xu G., Zhigang Cai, Qingxing Li, and Zhenxin Yu. "Picosecond photoluminescence of hydrogenated amorphous carbon." In OE/LASE '92, edited by William G. Golden. SPIE, 1992. http://dx.doi.org/10.1117/12.59298.

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Inaba, Hiroshi, Toru Matsumura, Yoko Saito, and Hiroyuki Matsumoto. "Tetrahedral Amorphous Carbon With Ultratrace Hydrogen." In ASME 2014 Conference on Information Storage and Processing Systems. American Society of Mechanical Engineers, 2014. http://dx.doi.org/10.1115/isps2014-6928.

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In heat assisted magnetic recording (HAMR) where near-field light from a head heats up a disk, disk overcoat needs to be heat-resistive and transparent. ta-C (tetrahedral amorphous carbon) films have been considered to be promising for HAMR disk overcoat, because they are denser and harder than diamond-like carbon (DLC) films that have been used as disk overcoat. In the previous study, ta-C did not show any change in the film thickness by heating up to 450 degrees Celsius, approving a heat-resistant high protective film [1]. The purpose of this study is to investigate enhanced ta-C, which is harder, denser and higher-thermostability than those of conventional ta-C in reference to that nanometer-sized diamonds were more stable than graphite by adding the small amount of hydrogen [2]. In this report, ultratrace hydrogenerated ta-C, amorphous films, was investigated to expect similar effect as was observed in the crystalline films.
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Guseva, M. B., V. M. Babina, M. Boustie, Vladimir E. Fortov, J. P. Romain, A. Z. Zhuk, V. G. Babaev, and V. V. Khvostov. "Synthesis of carbyne from amorphous line-chain carbon and pyrographite." In Lasers in Synthesis, Characterization, and Processing of Diamond, edited by Vitali I. Konov and Victor G. Ralchenko. SPIE, 1998. http://dx.doi.org/10.1117/12.328213.

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Anikeeva, I. V., A. B. Arbuzov, M. V. Trenikhin, and Yu G. Kryazhev. "Formation of carbon-carbon composite materials with nanoglobular carbon particles embedded in amorphous carbon matrix." In 21ST CENTURY: CHEMISTRY TO LIFE. AIP Publishing, 2019. http://dx.doi.org/10.1063/1.5122941.

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Mohamad, F., U. M. Noor, M. Rusop, Mohamad Rusop, and Tetsuo Soga. "Ohmic Contact To Amorphous Carbon Thin Films." In NANOSCIENCE AND NANOTECHNOLOGY: International Conference on Nanoscience and Nanotechnology—2008. AIP, 2009. http://dx.doi.org/10.1063/1.3160217.

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Reports on the topic "Amorphous Carbon"

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McLaughlin, C. Fabricating Diamond-like Amorphous Carbon. Office of Scientific and Technical Information (OSTI), August 2021. http://dx.doi.org/10.2172/1821818.

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Falabella, S., J. S. Miller, A. Ceballos-Sanchez, S. O. Kucheyev, and S. Elhadj. Amorphous carbon coatings with controlled density and composition. Office of Scientific and Technical Information (OSTI), October 2019. http://dx.doi.org/10.2172/1573139.

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Hawari, Ayman. Thermal Neutron Scattering Cross Sections for Graphitic Amorphous Carbon. Office of Scientific and Technical Information (OSTI), June 2022. http://dx.doi.org/10.2172/1873987.

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Sullivan, J. P., T. A. Friedmann, R. G. Dunn, E. B. Stechel, and P. A. Schultz. The electronic transport mechanism in amorphous tetrahedrally-coordinated carbon films. Office of Scientific and Technical Information (OSTI), February 1998. http://dx.doi.org/10.2172/634073.

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Siegal, M. P., D. R. Tallant, J. C. Barbour, P. N. Provencio, L. J. Martinez-Miranda, and N. J. DiNardo. Characterization of amorphous carbon films grown by pulsed-laser deposition. Office of Scientific and Technical Information (OSTI), September 1998. http://dx.doi.org/10.2172/658461.

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Ager III, Joel W. Raman Spectroscopy Characterization of amorphous carbon coatings for computer hard disks. Office of Scientific and Technical Information (OSTI), May 1998. http://dx.doi.org/10.2172/767498.

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Moll, A. J., E. E. Haller, J. W. III Ager, K. M. Yu, and W. Walukiewicz. The effects of amorphous layer regrowth on carbon activation in GaAs and InP. Office of Scientific and Technical Information (OSTI), November 1993. http://dx.doi.org/10.2172/10120314.

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Anders, S., C. S. Bhatia, W. Fong, R. Y. Lo, and D. B. Bogy. Application of cathodic arc deposited amorphous hard carbon films to the head/disk tribology. Office of Scientific and Technical Information (OSTI), April 1998. http://dx.doi.org/10.2172/663565.

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Vandentop, G. J. A study of the chemical, mechanical, and surface properties of thin films of hydrogenated amorphous carbon. Office of Scientific and Technical Information (OSTI), July 1990. http://dx.doi.org/10.2172/6637587.

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Pisani, William, Dane Wedgeworth, Michael Roth, John Newman, and Manoj Shukla. Exploration of two polymer nanocomposite structure-property relationships facilitated by molecular dynamics simulation and multiscale modeling. Engineer Research and Development Center (U.S.), March 2023. http://dx.doi.org/10.21079/11681/46713.

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Polyamide 6 (PA6) is a semi-crystalline thermoplastic used in many engineering applications due to good strength, stiffness, mechanical damping, wear/abrasion resistance, and excellent performance-to-cost ratio. In this report, two structure-property relationships were explored. First, carbon nanotubes (CNT) and graphene (G) were used as reinforcement molecules in simulated and experimentally prepared PA6 matrices to improve the overall mechanical properties. Molecular dynamics (MD) simulations with INTERFACE and reactive INTERFACE force fields (IFF and IFF-R) were used to predict bulk and Young's moduli of amorphous PA6-CNT/G nanocomposites as a function of CNT/G loading. The predicted values of Young's modulus agree moderately well with the experimental values. Second, the effect of crystallinity and crystal form (α/γ) on mechanical properties of semi-crystalline PA6 was investigated via a multiscale simulation approach. The National Aeronautics and Space Administration, Glenn Research Center's micromechanics software was used to facilitate the multiscale modeling. The inputs to the multiscale model were the elastic moduli of amorphous PA6 as predicted via MD and calculated stiffness matrices from the literature of the PA6 α and γ crystal forms. The predicted Young's and shear moduli compared well with experiment.
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