标题: sobtop产生top文件时出现问题Unable to find "Cartesian Force Constants" [打印本页] 作者Author: outfind 时间: 2022-10-27 15:05 标题: sobtop产生top文件时出现问题Unable to find "Cartesian Force Constants" 首先加入mol2文件，按照教程最后添加fchk文件，然后出现错误Error: Unable to find "Cartesian Force Constants" from this file!
The fch/fchk file must be produced by "freq" task
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