The strong cooperative effect in the intermolecular interaction has a severe influence on the crystal structure and other important properties.
分子间作用中的强协同效应会对高能材料的晶体结构和重要性质产生重大影响。
The intermolecular interaction between liquid crystal and polymer molecules is considered to he very important for aligning liquid crystals on the polymer surface.
液晶和聚合物分子间的相互相用对于聚合物表而的液晶排列是非常重要的。
The intermolecular interaction energy is calculated with MP2 electron correlation correction, basis set superposition error (BSSE) correction and zero point energy (ZPE) correction.
经MP2电子相关和基组叠加误差(BSSE)以及零点能(ZPE)校正,求得分子间相互作用能;
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