The linear polarizabilities, the first-and second-order hyperpolarizabilities of these squaraines were calculated using TDHF method.
在此基础上用TDHF方法计算了分子的线性极化率、一阶和二阶超极化率。
2
The intense and sharp absorption of squaraines in the near IR and their highly selective decoloration induced by cyanide makes them suitable to serve as cyanide sensors.