Academic Journal
CARBON NANOCOILS: STRUCTURE AND STABILITY
| العنوان: | CARBON NANOCOILS: STRUCTURE AND STABILITY |
|---|---|
| المؤلفون: | Z P Popović, M Damnjanović, I Milošević |
| المساهمون: | The Pennsylvania State University CiteSeerX Archives |
| المصدر: | http://savremenimaterijali.info/sajt/doc/file/casopisi/3_1/7_ZoranPopovic.pdf. |
| المجموعة: | CiteSeerX |
| الوصف: | We have constructed a model of single-wall helically coiled carbon nanotubes by means of graph theory and topological coordinates method. After obtaining threedimensional coordinates of the atoms we proceed with the relaxation by successive application of the following methods: 1) harmonic approximation; 2) molecular mechanics based on the Brenner potential; and 3) density functional tight binding (DFTB). Finally, by DFTB and line group symmetry implemented POLSym code, we calculate total and cohesive energy of the obtained fully relaxed structures of CNCs. |
| نوع الوثيقة: | text |
| وصف الملف: | application/pdf |
| اللغة: | English |
| Relation: | http://citeseerx.ist.psu.edu/viewdoc/summary?doi=10.1.1.1072.9890; http://savremenimaterijali.info/sajt/doc/file/casopisi/3_1/7_ZoranPopovic.pdf |
| الاتاحة: | http://citeseerx.ist.psu.edu/viewdoc/summary?doi=10.1.1.1072.9890 http://savremenimaterijali.info/sajt/doc/file/casopisi/3_1/7_ZoranPopovic.pdf |
| Rights: | Metadata may be used without restrictions as long as the oai identifier remains attached to it. |
| رقم الانضمام: | edsbas.66DCB831 |
| قاعدة البيانات: | BASE |
| الوصف غير متاح. |