Systematic Investigation on CPL Properties of Various Chiral Motifs Through Theoretical Calculation
化学
计算机科学
计算生物学
生物
作者
Yuuya Nagata
标识
DOI:10.1002/9783527841110.ch28
摘要
In the development of new CPL materials, the prediction based on the theoretical calculation is becoming increasingly important along with actual synthesis. From a practical aspect, this chapter introduces recent reports on the prediction of CPL properties using the time-dependent density functional theory (TDDFT) method, categorized by the chiral motifs.