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Schaeffer et al. [11] calculated a value of 117.68 with a large basis set at the CISD level of theoryÔõô·£¿ |
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ÖÁ×ðľ³æ (Ö°Òµ×÷¼Ò)
- ·ÒëEPI: 244
- Ó¦Öú: 8 (Ó×¶ùÔ°)
- ¹ó±ö: 0.015
- ½ð±Ò: 10699.3
- É¢½ð: 437
- ºì»¨: 30
- Ìû×Ó: 3868
- ÔÚÏß: 1074.8Сʱ
- ³æºÅ: 611748
- ×¢²á: 2008-09-25
- ÐÔ±ð: GG
- רҵ: ÉúÎïÎÞ»ú»¯Ñ§
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sltmac(½ð±Ò+1): лл½»Á÷~~ 2011-06-09 09:14:12
0832010026(½ð±Ò+10, ·ÒëEPI+1): ллŶ£¡ 2011-06-09 13:56:33
sltmac(½ð±Ò+1): лл½»Á÷~~ 2011-06-09 09:14:12
0832010026(½ð±Ò+10, ·ÒëEPI+1): ллŶ£¡ 2011-06-09 13:56:33
| SchaefferµÈ [11]ÔÚµ¥¡¢Ë«¼¤·¢×é̬Ï໥×÷ÓÃÀíÂÛ£¨CISD£¬configuration interaction with single and double excitations£©²ãÃæÀûÓÃÒ»¸ö´ó»ù×鼯ËãµÃµ½ÁË117.68Õâ¸öÖµ¡£ |

2Â¥2011-06-09 02:44:34














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