Investigation of Interactions of Acetylene Molecules with an Iron Nanowire and Its Effects on Mechanical Tensile Properties

aral, gurcan

doi:10.16984/saufenbilder.793699

Investigation of Interactions of Acetylene Molecules with an Iron Nanowire and Its Effects on Mechanical Tensile Properties

Gürcan ARAL (İzmir Yüksek Teknoloji Enstitüsü, İzmir, Türkiye)

Sakarya Üniversitesi Fen Bilimleri Enstitüsü Dergisi

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Yıl: 2021 Cilt: 25 Sayı: 1 Sayfa Aralığı: 220 - 229 Metin Dili: İngilizce DOI: 10.16984/saufenbilder.793699 İndeks Tarihi: 11-06-2021

Investigation of Interactions of Acetylene Molecules with an Iron Nanowire and Its Effects on Mechanical Tensile Properties

Öz:

Understanding complex atomistic-scales interactions mechanisms of reactive acetylene (C2H2)molecules with reactive pure iron nanowires (Fe NWs) including its effects on the tensilemechanical properties of NWs is a crucial task in nanotechnology, especially having practicalsignificance in the mechanical reliability, durability and stability. Therefore, we performedmolecular dynamics (MD) simulations based on ReaxFF reactive force field interatomicpotential model to investigate the interactions of C2H2 molecules with surface of cylindricalpure Fe NW and its fundamental effects on the tensile mechanical deformations properties ofNWs at three different strain rates. Our results reveal that the chemical energetic reactions onthe free surface of cylindrical Fe NW with C2H2 molecules in the gas phase form FexCyHzshell layer at temperature T=300 K. The presence of FexCyHz shell layer on the free surface ofNW has a significant effect on the mechanical tensile deformation mechanism of the NWs.

Anahtar Kelime:

Belge Türü: Makale Makale Türü: Araştırma Makalesi Erişim Türü: Erişime Açık

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APA	aral g (2021). Investigation of Interactions of Acetylene Molecules with an Iron Nanowire and Its Effects on Mechanical Tensile Properties. , 220 - 229. 10.16984/saufenbilder.793699
Chicago	aral gurcan Investigation of Interactions of Acetylene Molecules with an Iron Nanowire and Its Effects on Mechanical Tensile Properties. (2021): 220 - 229. 10.16984/saufenbilder.793699
MLA	aral gurcan Investigation of Interactions of Acetylene Molecules with an Iron Nanowire and Its Effects on Mechanical Tensile Properties. , 2021, ss.220 - 229. 10.16984/saufenbilder.793699
AMA	aral g Investigation of Interactions of Acetylene Molecules with an Iron Nanowire and Its Effects on Mechanical Tensile Properties. . 2021; 220 - 229. 10.16984/saufenbilder.793699
Vancouver	aral g Investigation of Interactions of Acetylene Molecules with an Iron Nanowire and Its Effects on Mechanical Tensile Properties. . 2021; 220 - 229. 10.16984/saufenbilder.793699
IEEE	aral g "Investigation of Interactions of Acetylene Molecules with an Iron Nanowire and Its Effects on Mechanical Tensile Properties." , ss.220 - 229, 2021. 10.16984/saufenbilder.793699
ISNAD	aral, gurcan. "Investigation of Interactions of Acetylene Molecules with an Iron Nanowire and Its Effects on Mechanical Tensile Properties". (2021), 220-229. https://doi.org/10.16984/saufenbilder.793699

APA	aral g (2021). Investigation of Interactions of Acetylene Molecules with an Iron Nanowire and Its Effects on Mechanical Tensile Properties. Sakarya Üniversitesi Fen Bilimleri Enstitüsü Dergisi, 25(1), 220 - 229. 10.16984/saufenbilder.793699
Chicago	aral gurcan Investigation of Interactions of Acetylene Molecules with an Iron Nanowire and Its Effects on Mechanical Tensile Properties. Sakarya Üniversitesi Fen Bilimleri Enstitüsü Dergisi 25, no.1 (2021): 220 - 229. 10.16984/saufenbilder.793699
MLA	aral gurcan Investigation of Interactions of Acetylene Molecules with an Iron Nanowire and Its Effects on Mechanical Tensile Properties. Sakarya Üniversitesi Fen Bilimleri Enstitüsü Dergisi, vol.25, no.1, 2021, ss.220 - 229. 10.16984/saufenbilder.793699
AMA	aral g Investigation of Interactions of Acetylene Molecules with an Iron Nanowire and Its Effects on Mechanical Tensile Properties. Sakarya Üniversitesi Fen Bilimleri Enstitüsü Dergisi. 2021; 25(1): 220 - 229. 10.16984/saufenbilder.793699
Vancouver	aral g Investigation of Interactions of Acetylene Molecules with an Iron Nanowire and Its Effects on Mechanical Tensile Properties. Sakarya Üniversitesi Fen Bilimleri Enstitüsü Dergisi. 2021; 25(1): 220 - 229. 10.16984/saufenbilder.793699
IEEE	aral g "Investigation of Interactions of Acetylene Molecules with an Iron Nanowire and Its Effects on Mechanical Tensile Properties." Sakarya Üniversitesi Fen Bilimleri Enstitüsü Dergisi, 25, ss.220 - 229, 2021. 10.16984/saufenbilder.793699
ISNAD	aral, gurcan. "Investigation of Interactions of Acetylene Molecules with an Iron Nanowire and Its Effects on Mechanical Tensile Properties". Sakarya Üniversitesi Fen Bilimleri Enstitüsü Dergisi 25/1 (2021), 220-229. https://doi.org/10.16984/saufenbilder.793699