Method for Measurement of the Nanocluster Form Within Atomistic Computer Simulation
| Authors | A.I. Kul’ment’ev1, O.P. Kul’ment’eva2 |
| Affiliations | 1 Institute of Applied Physics National Academy of Sciences of Ukraine, Petropavlovskaya Str, 58, 40030, Sumy, Ukraine 2 Sumy State University, Rimsky-Korsakov Str., 2, 40007, Sumy, Ukraine |
| Е-mail | kulmentev@ipfcentr.sumy.ua |
| Issue | Volume 1, Year 2009, Number 3 |
| Dates | Received 05.10.2009, in final form 27.11.2009 |
| Citation | English version is not accessible |
| DOI | |
| PACS Number(s) | 83.10.Rs, 87.15. A – |
| Keywords | Computer simulation (2) , Reactor material science, Nanophysics, Space-time levels, Nanocluster (4) , Moment-of-inertia tensor. |
| Annotation |
Numerical technique for measurement the form of local atomic formation with well-defined exterior boundary was presented. Algorithms were analyzed, necessary software was developed and tested for the model clusters. For the series of equilibrium clusters with Lennard-Jones interparticle interactions the form of clusters was measured. It was shown that for such clusters within the framework of proposed method both the oscillations of size-dependent properties and sequence of magic numbers are correctly reproduced. |
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List of References English version of article |
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