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楼主您好,我安装了WSL并且,下载配置好了Linux版本的Multiwfn,但是运行脚本一直报错,想请教一下您,感谢!“zzh@LAPTOP-LTMH4CC5:~/software/Multiwfn Linux$ ./tstb -m td -n 5 -g 3 -b 1-8,10-13,33-39 -d 9,14-32,40-52 -a 53-90 DM-B.fchk DM-B.log
/home/zzh/software/Multiwfn Linux/Multiwfn
(standard_in) 2: syntax error
EOF encountered in a comment.
(standard_in) 1: syntax error
EOF encountered in a comment.
(standard_in) 1: syntax error
TS/TB using transition density:
Through Space CT: 0.00000 0.00%
Through Bond CT: 0.00000 0.00%
Tot transit dens: 0.00000”这些是报错内容 |
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