计算化学公社
标题:
求助NBO运行问题,同样配置运行NBO6可以运行,NBO7运行失败
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作者Author:
jisuan1lin
时间:
3 hour ago
标题:
求助NBO运行问题,同样配置运行NBO6可以运行,NBO7运行失败
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按照卢天老师帖子里的NBO解压之后添加路径
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同样gjf文件分别添加关键词pop=nbo6,pop=nbo7。nbo6能运行,但是nbo7显示错误
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同样pop=nbo6关键词运行成功
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求大佬们解答
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