The quantum chemical theoretic and experimental studies on the configuration,state of aggregation and carbocyanine molecular structure domino effect of its properties are introduced in this paper.
本文介绍了子构型、聚集态及
子性质的结构效应的量子化学
实验研究情况,综
了国内外学者对
子的量子化学计算方法的研究进展。