Paper
17 June 2009 Study of single structure of Con (n=6, 8, 10, 12, 14,16,18) nanoparticles
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Abstract
Electronic and geometrical structures of Con (n=6, 8, 9, 10, 12, 14) particles have been studied using both the density functional theory and Hartree-Fock calculations. Structural and electronic differences to the corresponding clusters are presented. We have tried to recognize which structure (fcc or bcc) is more preferable for these particles. A four-fold and higher coordination of the Co atoms was found to be the particularly preferable coordination environment in small Con species. The key element of the Co particle is alsosuggested.
© (2009) COPYRIGHT Society of Photo-Optical Instrumentation Engineers (SPIE). Downloading of the abstract is permitted for personal use only.
Jelena Tamulienė, Goncal Badenes, Rimas Vaišnoras, Mindaugas L. Balevičius, and Loreta Rasteniene "Study of single structure of Con (n=6, 8, 10, 12, 14,16,18) nanoparticles", Proc. SPIE 7377, Twelfth International Workshop on Nanodesign Technology and Computer Simulations, 737709 (17 June 2009); https://doi.org/10.1117/12.836438
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KEYWORDS
Particles

Chemical species

Nanoparticles

Cobalt

Crystals

Magnetism

Chemical elements

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