计算化学公社
标题: 审稿人让我模拟荧光,想请问如何使用gaussian模拟荧光,最好有gjf文件参考一下 [打印本页]
作者Author: 1795467706 时间: 2025-5-29 11:15
标题: 审稿人让我模拟荧光,想请问如何使用gaussian模拟荧光,最好有gjf文件参考一下
Section 3.7compares the theoretical calculations with experimental results for theabsorption spectra of the complexes, but Section 3.8 (Fluorescence spectra)only includes experimental results and lacks theoretical calculations andcomparisons??如上审稿意见,应该如何用gaussian模拟荧光呢
作者Author: zjxitcc 时间: 2025-5-29 11:18
Gaussian中用TDDFT计算激发态和吸收、荧光、磷光光谱的方法
http://sobereva.com/314
欢迎光临 计算化学公社 (http://bbs.keinsci.com/) |
Powered by Discuz! X3.3 |