The new methods of energy partition and geometry optimization under restrictions of orbital interactions are introduced,and these are developed in our research group.
简要地介绍能量分解法的发展历史,强调能量分解的特点是给量子化学的计算提供明确的化学意义,介绍本实验室建立的能量分解法和限制轨道作用的几何优化法。
Study on return current around ship and ship sinkage in a restricted channel;
限制性航道船周回流速度与船体下沉研究