Abstract
A Fe-based BCC small nanocluster was calculated at the non-equilibrium conditions with a carbon atom in octahedral interstitial site. Such a cluster was considered as a nanoscale analog of an iron α-phase. The chosen BCC iron nanosystem is regarded, as the prospective prototype of the nanomaterial in the medical, ecological, catalysis, fields as well as the nanopowders for 3D printers.The possible directions of the carbon atom's motion to the surface and the specific energy changes are determined to take into account of substitutional nickel atom positions. The influence of the doped nickel atom on the energy-favorable direction of drift of the carbon atom is established. Estimates of specific energy changing were calculated in all possible positions of the nickel and carbon atoms. The energetic reasons are determined that can explain the low solubility of carbon atoms in an iron BCC structure similar to ferrite.List of abbreviationsBCC: body centered cubic
Sign-in/Register to access full text options 
Talk to us
Join us for a 30 min session where you can share your feedback and ask us any queries you have
Schedule a callDisclaimer: All third-party content on this website/platform is and will remain the property of their respective owners and is provided on "as is" basis without any warranties, express or implied. Use of third-party content does not indicate any affiliation, sponsorship with or endorsement by them. Any references to third-party content is to identify the corresponding services and shall be considered fair use under The CopyrightLaw.
