Multiwfn导入fch文件时出现!!!
Warning: Found d or higher angular momentum spherical gaussian functions!
only a little functions in Multiwfn support these function types (see readme file)
, for using other functions you should add "6d 10f" keyword in route section of
Gaussian input file and generate .fch file again.
Multiwfn needs Gaussian output file to loaded in overlap matrix, please input t
he path of the output file (SP task with iop(3/33=1))
求具体的解决方法，谢谢！
[ Last edited by gufengmei on 2011-4-16 at 09:43 ]
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