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Updated: Jul 11, 2026

Novel 3D/VR Interactive Environment for MD Simulations, Visualization and Analysis
11:29

Novel 3D/VR Interactive Environment for MD Simulations, Visualization and Analysis

Published on: December 18, 2014

炭素とナノ構造の炭素/シリコン前駆体の構造と熱力学

Vassiliki-Alexandra Glezakou1, Jerry A Boatz, Mark S Gordon

  • 1San Diego Supercomputer Centre, University of California San Diego, 9500 Gilman Drive, MC0505, La Jolla, California 92093-0505, USA.

Journal of the American Chemical Society
|May 23, 2002
PubMed
まとめ

計算化学は,C ((36) H ((16)) とそのシリコンドーピングされた形態が,構造的およびエネルギー的な変化をどのように受けているかを明らかにします. この研究は,全炭素系から炭素ナノチューブ形成につながる二酸化経路を探索しています.

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