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搜索结果: 1-5 共查到凹凸棒石 Computer Simulation相关记录5条 . 查询时间(0.285 秒)
Atomisticsimulationsusinglatticeandmoleculardynamicswerecarriedoutonthe {210},{310},and{410}tiltgrainboundariesofMgOasafunctionofpressureupto100 GPaatasingletemperatureof600K.Thecalculationsshowasig...
The lattice dynamics computer code PARAPOCS was successfully used to calculate the 240 vibrational frequencies of pyrope garnet, Mg3Al2Si3O12, at ambient conditions. The atomic displacement vectors (e...
Ala~ge-s~ale computer. simulation ofAl-Siordering and the corresponding development ofa twm mIcrostructure malkali feldspars is reported for the first time. In the simulation the o~der-disorder transi...
A new model for the description of the structural disorder in natural kaolinite materials is proposed, based on the stacking of two 1:1 layers and their enantiomorphs, and encompassing previously prop...
A new approach is described to computer simulate cation distribution in octahedral sheets of dioctahedral 2:1 layer silicates with vacant trans-octahedra. This approach makes use of the information on...

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