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|---|---|---|
 Date: 2004-03-02 13:49:34Bond-dissociation energy Alkane stereochemistry Hydrogen bond Bond order Chemical bond Molecular dynamics ReaxFF Atoms in molecules Carbon–hydrogen bond Chemistry Chemical bonding Force field |
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No Job Name | 碳烟纳米颗粒形成路径的反应分子动力学(ReaxFF MD)模拟 韩嵩 中国科学院过程工程研究所 - 介尺度研究部 研究背景 碳烟形成的详细化学反应路径仍不清楚DocID: 1uBbF - View Document |
| WILLIAM A. GODDARD, III California Institute of Technology: Charles and Mary Ferkel Professor of Chemistry, Materials Science, and Applied Physics Director of Materials and Process Simulation Center (MSC) MC; 1200DocID: 1o5rB - View Document |
| 分子動力学計算ソフトウェア ●反応力場 ReaxFF ・AB: (H/O/N/B) Ammonia Borane ・AuO: (Au/O)DocID: 1mz0b - View Document |
| Microsoft Word - Harris.docDocID: 1fJRo - View Document |
| Microsoft Word - CFN PublicationsdocxDocID: 1fIfX - View Document |