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tlzp

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xhtangxh

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wenti1695

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tlzp: ½ð±Ò+3, ¡ïÓаïÖú, ÎÒÖ÷Òª¿´µ½¡¶½á¹¹»¯Ñ§¡·ÀïÒ»°ã¶¼ÓУ¬ÎÒ¾ÍÏëŪ¸ö£¬µ«²»ÖªµÀÔõôŪ£¿ 2013-12-06 10:20:10
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forever1706

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tlzp: ½ð±Ò+5, ¡ï¡ï¡ïºÜÓаïÖú, ÎÒÖ÷Òª¿´µ½¡¶½á¹¹»¯Ñ§¡·ÀïÒ»°ã¶¼ÓУ¬ÎÒ±¾À´¾ÍûÓÐʲôÐÔÖÊ£¬ÎÒ¾ÍÏëŪ¸ö£¬µ«²»ÖªµÀÔõôŪ£¿ 2013-12-06 10:21:23
It is necessary for your key point or is it highly related to what you want to say in your paper? If not, you do not have to do it.
4Â¥2013-12-06 01:18:52
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forever1706

½û³æ (ÖªÃû×÷¼Ò)

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Use DFT (Gauss, Turbomole, ADF...)to optimize your geometry and then you can calculate the HOMO and LUMO of your molecule.
5Â¥2013-12-07 01:50:12
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