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Pressure effect of structural and vibrational properties of solid pentaerythritol by molecular dynamics simulations 期刊论文
Physica B-Condensed Matter, 2012, 卷号: 407, 期号: 19, 页码: 3996-4000
作者:  L. Y. Lu;  X. L. Zhou;  X. R. Chen
收藏  |  浏览/下载:111/0  |  提交时间:2013/02/05
Molecular Dynamics  High Pressure  High Explosives  Vibrational  Properties  Neutron-diffraction  Force-field  X-ray  Raman  Refinement  Crystals  Compass  Spectra  Nitrate  Wave  
The pressure-induced phase transition of the solid -HMX 期刊论文
Molecular Physics, 2009, 卷号: 107, 期号: 22, 页码: 2373-2385
作者:  L. Y. Lu;  D. Q. Wei;  X. R. Chen;  G. F. Ji;  X. J. Wang;  J. Chang;  Q. M. Zhang;  Z. Z. Gong
Adobe PDF(1434Kb)  |  收藏  |  浏览/下载:64/0  |  提交时间:2012/04/13
-hmx Crystal  Octahydro-1  Molecular Dynamics  3  High Pressure Compression  5  Phase  7-tetranitr  Transition  Vibrational Frequencies  Beta-cyclotetramethylene Tetranitramine  Molecular-dynamics Simulations  Compass Force-field  Vibrational-spectra  Crystal Structure