Structural, vibrational and thermodynamic properties of carbon allotropes from first-principles : diamond, graphite, and nanotubes
Thesis (S.M.)--Massachusetts Institute of Technology, Dept. of Materials Science and Engineering, 2005. === Includes bibliographical references (p. 95-104). === The structural, dynamical, and thermodynamic properties of different carbon allotropes are computed using a combination of ab-initio method...
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| Format: | Others |
| Language: | English |
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Massachusetts Institute of Technology
2006
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| Online Access: | http://hdl.handle.net/1721.1/33400 |