²é¿´: 1344  |  »Ø¸´: 3
µ±Ç°Ö÷ÌâÒѾ­´æµµ¡£
µ±Ç°Ö»ÏÔʾÂú×ãÖ¸¶¨Ìõ¼þµÄ»ØÌû£¬µã»÷ÕâÀï²é¿´±¾»°ÌâµÄËùÓлØÌû

que66

Òø³æ (СÓÐÃûÆø)

[½»Á÷] ʲôÊÇ×ÔÇ¢³¡ÀíÂÛ£¿Ëü¶¼ÓÃÔÚÄÄЩµØ·½£¿

ʲôÊÇ×ÔÇ¢³¡ÀíÂÛ£¿Ëü¶¼ÓÃÔÚÄÄЩµØ·½£¿
ÓÐʲôÓÅȱµã
£¿
»Ø¸´´ËÂ¥
ÒÔÓ¦ÓÃÑøÀíÂÛ¡¢ÒÔÀíÂÛ´ÙÓ¦Óá£
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

zhanghd

ľ³æ (СÓÐÃûÆø)

ÐÂÊéhttp://muchong.com/bbs/viewthread.php?tid=642719&fpage=1¾ÍÊÇ×ÔÇ¢³¡ÀíÂ۵ĴóÅ£FredricksonµÄ´ó×÷£¬Ïêϸ½²×ÔÇ¢³¡Ôڸ߷Ö×Ó¶àÏàÌåϵÖеÄÓ¦Óá£
¸ß·Ö×ÓÖеÄ×ÔÇ¢³¡ÀíÂÛ´Ó¸ß˹Á´Ä£Ðͳö·¢£¬Ò»¶¨³Ì¶ÈÉÏ½è¼øÁËÁ¿×Ó»¯Ñ§µÄ×ÔǢƽ¾ù³¡½üËÆ(Hatree-Fock½üËÆ)´¦Àí·½·¨£¬Æä»ù±¾Ë¼ÏëÊǽ«¸ß·Ö×ÓÁ´¸÷ÖÖÁ´¶ÎÓëÁ´¶ÎÖ®¼ä¸´ÔӵĶàÌåÏ໥×÷ÓÃÎÊÌ⣬¿´×÷ÊÇÒ»Ìõ¸ß·Ö×ÓÁ´ÓëÆ½¾ù³¡µÄ×÷Ó㬿ÉÒÔͨ¹ýÊýÖµ½âµÄ·½·¨°´ÄÜÁ¿¼«Ð¡µÄÔ­Ôò£¬ÀûÓó¡ºÍŨ¶ÈµÄ×ÔÇ¢µü´ú£¬½â³ö¶à×é·Ý¸ß·Ö×ÓÔÚÈÈÁ¦Ñ§Æ½ºâ״̬ʱµÄ¿Õ¼äŨ¶È·Ö²¼£¬¶øÇÒ±£ÁôÒ»¶¨µÄÁ´¹¹ÏóÐÅÏ¢£¬ÀíÂÛÐÎʽ¼°Æä½á¹û·Ç³£ÓÅÃÀ¡£

[ Last edited by zhanghd on 2007-11-30 at 00:48 ]
3Â¥2007-11-30 00:42:24
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû
²é¿´È«²¿ 4 ¸ö»Ø´ð

macromole

ÖÁ×ðľ³æ (ÖøÃûдÊÖ)

ÒýÓûØÌû:
Originally posted by que66 at 2007-11-29 18:46:
ʲôÊÇ×ÔÇ¢³¡ÀíÂÛ£¿Ëü¶¼ÓÃÔÚÄÄЩµØ·½£¿
ÓÐʲôÓÅȱµã
£¿

×ÔÇ¢³¡ÀíÂÛÃ²ËÆÊǸöÎïÀíѧµÄÀíÂÛ¡£¾ßÌåÎÒÒ²²»¶®£¬µ«ÊÇÔÚÊéÉÏ¿´µ½¹ý¡£
¸ß·Ö×Ó·½Ã棬·¨¹úÈËPGµÂÈÈÄÉÔËÓÃ×ÔÇ¢³¡ÀíÂÛ´¦ÀíһЩ¸ß·Ö×ÓÎïÀíµÄ»ù±¾ÀíÂÛÎÊÌ⣬µÃµ½Á˺ܼòµ¥µÄ½áÂÛ¡£ºÜºÃºÜÇ¿´ó¡£
Ïêϸ×ÊÁÏÇëÂ¥Ö÷×ÔÐвο´PGµÂÈÈÄɵġ¶¸ß·Ö×ÓÎïÀíÖеıê¶È¸ÅÄî¡·Ò»Êé¡£
ÏÞÓÚˮƽ£¬±¾ÈËÎÞ·¨¾ÍÓÅȱµãÎÊÌâ¸øÓë»Ø´ð¡£²»ºÃÒâ˼¡£
2Â¥2007-11-29 23:51:57
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

que66

Òø³æ (СÓÐÃûÆø)

ºÃ²»´í

¹ÄÀø£¡Ï£ÍûÓиüÏêϸµÄ»Ø´ð£¡
ÒÔÓ¦ÓÃÑøÀíÂÛ¡¢ÒÔÀíÂÛ´ÙÓ¦Óá£
4Â¥2007-12-02 14:55:51
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû
×î¾ßÈËÆøÈÈÌûÍÆ¼ö [²é¿´È«²¿] ×÷Õß »Ø/¿´ ×îºó·¢±í
[ÂÛÎÄͶ¸å] ÉêÇë»Ø¸åÑÓÆÚÒ»¸öÔ£¬±à¼­Í¬ÒâÁË¡£µ«ÏµÍ³ÉϵÄʱ¼äû±ä£¬¸ø±à¼­ÓÖдÓʼþÁË£¬Ã»»Ø¸´ 10+3 wangf9518 2026-03-17 4/200 2026-03-19 23:55 by babero
[¿¼ÑÐ] 288Çóµ÷¼Á +15 ÓÚº£º£º£º£ 2026-03-19 15/750 2026-03-19 22:41 by ѧԱ8dgXkO
[¿¼ÑÐ] Áº³ÉΰÀÏʦ¿ÎÌâ×é»¶Ó­ÄãµÄ¼ÓÈë +9 һѼѼӴ 2026-03-14 11/550 2026-03-19 17:22 by £¡±¾°µÒ»´Î£¡
[¿¼ÑÐ] ¸´ÊÔµ÷¼Á +4 z1z2z3879 2026-03-14 6/300 2026-03-19 17:18 by fei626-918
[¿¼ÑÐ] 321Çóµ÷¼Á +8 ºÎÈó²É123 2026-03-18 10/500 2026-03-19 16:46 by ºÎÈó²É123
[¿¼ÑÐ] ÄÜÔ´²ÄÁÏ»¯Ñ§¿ÎÌâ×éÕÐÊÕ˶ʿÑо¿Éú8-10Ãû +4 ÍÑÓ±¶ø³ö 2026-03-16 12/600 2026-03-19 16:17 by ÍÑÓ±¶ø³ö
[¿¼ÑÐ] 0703»¯Ñ§µ÷¼Á +5 pupcoco 2026-03-17 8/400 2026-03-19 13:58 by houyaoxu
[¿¼ÑÐ] 346Çóµ÷¼Á[0856] +3 WayneLim327 2026-03-16 6/300 2026-03-19 11:21 by WayneLim327
[¿¼ÑÐ] ²ÄÁÏ080500µ÷¼ÁÇóÊÕÁô +4 Ò»¿Åmeteor 2026-03-13 4/200 2026-03-19 10:32 by 30660438
[¿¼ÑÐ] 330Çóµ÷¼Á +3 С²Ä»¯±¾¿Æ 2026-03-18 3/150 2026-03-18 21:55 by ÎÞи¿É»÷111
[¿¼ÑÐ] 295Çóµ÷¼Á +3 Ò»Ö¾Ô¸¾©Çø211 2026-03-18 5/250 2026-03-18 17:03 by zhaoqian0518
[¿¼ÑÐ] »¯Ñ§¹¤³Ì321·ÖÇóµ÷¼Á +15 ´óÃ×·¹£¡ 2026-03-15 18/900 2026-03-18 14:52 by haxia
[¿¼ÑÐ] 311Çóµ÷¼Á +6 26ÑÐ0 2026-03-15 6/300 2026-03-18 14:43 by haxia
[¿¼ÑÐ] 298-Ò»Ö¾Ô¸Öйúũҵ´óѧ-Çóµ÷¼Á +7 ÊÖ»úÓû§ 2026-03-17 7/350 2026-03-18 14:34 by vgtyfty
[¿¼ÑÐ] 303Çóµ÷¼Á +4 î£08 2026-03-17 6/300 2026-03-18 11:01 by Iveryant
[¿¼ÑÐ] 334Çóµ÷¼Á +3 Ö¾´æ¸ßÔ¶ÒâÔÚ»úÐ 2026-03-16 3/150 2026-03-18 08:34 by lm4875102
[¿¼ÑÐ] ²ÄÁÏר˶326Çóµ÷¼Á +6 Ä«ìÏæ¦Ý· 2026-03-15 7/350 2026-03-17 17:10 by ruiyingmiao
[¿¼ÑÐ] 283Çóµ÷¼Á +3 Ìý·ç¾ÍÊÇÓꣻ 2026-03-16 3/150 2026-03-17 07:41 by ÈÈÇéɳĮ
[¿¼ÑÐ] 11408 Ò»Ö¾Ô¸Î÷µç£¬277·ÖÇóµ÷¼Á +3 zhouzhen654 2026-03-16 3/150 2026-03-17 07:03 by laoshidan
[¿¼ÑÐ] Ò»Ö¾Ô¸¹þ¹¤´ó²ÄÁÏ324·ÖÇóµ÷¼Á +5 ãÆÐñ¶« 2026-03-14 5/250 2026-03-14 14:53 by ľ¹Ï¸à
ÐÅÏ¢Ìáʾ
ÇëÌî´¦ÀíÒâ¼û