Znn3bq.jpeg
²é¿´: 231  |  »Ø¸´: 2
µ±Ç°Ö÷ÌâÒѾ­´æµµ¡£

huilaoshu999

½ð³æ (ÖøÃûдÊÖ)

[½»Á÷] [ÇóÖú]µ¥ÖØ-ÈýÖØ¼¤·¢Ô¾Ç¨µÄÎüÊÕ¹âÆ×

ÇëÎÊÈçºÎ¼ÆËãµ¥ÖØ-ÈýÖØ¼¤·¢Ô¾Ç¨µÄÎüÊÕ¹âÆ×£¿Ð»Ð»ÄúµÄÖ¸µ¼£¡
»Ø¸´´ËÂ¥
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

jghe

½ð³æ (ÖøÃûдÊÖ)

ʲôÒâ˼£¿ µ¥ÖØÌ¬µ½ÈýÖØÌ¬µÄԾǨ£¿ÕâÊǽû½äµÄ°¢£¬Èç¹û·Ö±ðËãµ¥ÖØÌ¬ºÍÈýÖØÌ¬¾Í·Ö±ð¼Ósinglets ºÍtriplets ¾ÍÐÐÁË
2Â¥2008-07-25 21:03:54
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

beefly

ר¼Ò¹ËÎÊ (Ö°Òµ×÷¼Ò)

µØ¹µÓÍÒ±Á¶×¨¼Ò

¡ï ¡ï
zzgyb(½ð±Ò+2,VIP+0):ллÄãµÄ²ÎÓ룬»¶Ó­ÔٴιâÁÙ¼ÆËãÄ£Äâ°æ£¡
Èç¹ûÄãÖ¸µÄÊǼ¤·¢ÄܼÆË㣬gaussianµÄ·½·¨tddft£¬casscf£¬sac-ci£¬cis£¬zindo¶¼¿ÉÒÔ¡£µ«²»°üº¬Ðý¹ìñîºÏ¡£

Èç¹û¹ØÐĵÄÊÇԾǨ¾Ø¡¢·øÉäÊÙÃü¡¢Õñµ´Ç¿¶È¡¢ÎüÊÕ·åÒ»ÀàµÄÐÅÏ¢£¬±ØÐ뿼ÂÇÐý¹ìñîºÏ¡£Õâ·½ÃæµÄ³ÌÐòÓÐadf£¬gamess-us£¬molcas£¬molpro£¬columbus¡£ÁíÍâdaltonÒ²¿ÉÒÔ×ö£¬µ«Êä³öÐÅÏ¢±È½ÏÉÙ¡£¿ÉÒÔ¿´Õâ¸öÀý×Ó£º

http://new.quantumchemistry.net/ ... data/dalton-es.html
beefly¡¶Î÷̫ƽÑó´óѧÏÖ´úÓ¢ºº´Êµä¡·[bi:fli]Å£ÈâÒ»°ãµØ
3Â¥2008-07-25 23:01:19
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû
Ïà¹Ø°æ¿éÌø×ª ÎÒÒª¶©ÔÄÂ¥Ö÷ huilaoshu999 µÄÖ÷Ìâ¸üÐÂ
×î¾ßÈËÆøÈÈÌûÍÆ¼ö [²é¿´È«²¿] ×÷Õß »Ø/¿´ ×îºó·¢±í
[¿¼ÑÐ] 298Çóµ÷¼Á +4 ¶¤¶£ß˶¬¹Ï 2026-04-09 4/200 2026-04-10 02:18 by belle15
[¿¼ÑÐ] Çóµ÷¼Á +4 ôæôæÒ»ÊéÉú 2026-04-09 4/200 2026-04-10 00:07 by lwk2004
[¿¼ÑÐ] 301Çóµ÷¼Á +3 XYPLR 2026-04-05 5/250 2026-04-09 20:55 by lbsjt
[¿¼ÑÐ] 283Çóµ÷¼Á£¬¹¤¿Æ£¡ +8 ËÕ´òË®7777 2026-04-08 8/400 2026-04-09 20:50 by xujun0624
[¿¼ÑÐ] 297Çóµ÷¼Á +22 ljy20040718£¡ 2026-04-03 24/1200 2026-04-09 20:48 by yanenwang
[¿¼ÑÐ] 296Çóµ÷¼Á +5 Íô£¡£¿£¡ 2026-04-08 5/250 2026-04-09 16:47 by Delta2012
[¿¼ÑÐ] 085400µç×ÓÐÅÏ¢Àࣨ´¨´ó¿ØÖƹ¤³Ì£©Çóµ÷¼Á¿É¿çרҵ ÇóÀÏʦÁªÏµ +3 626776879 2026-04-08 3/150 2026-04-09 16:05 by Öí»á·É
[¿¼ÑÐ] 368»¯Ñ§Çóµ÷¼Á +13 wwwwabcde 2026-04-07 14/700 2026-04-09 14:47 by heaven_jay
[¿¼ÑÐ] ¶þ´Îµ÷¼ÁÇóÀÏʦÊÕÁô +3 ЦЦԬ 2026-04-08 3/150 2026-04-08 23:50 by ×íÔÚ·çÀï
[¿¼ÑÐ] ר˶310Çóµ÷¼Á +7 ÀÌÀÌÎÒ¡­. 2026-04-04 8/400 2026-04-08 20:24 by yutian743
[¿¼ÑÐ] Ò»Ö¾Ô¸»ª¶«Àí¹¤085601²ÄÁϹ¤³Ì303·ÖÇóµ÷¼Á +15 a1708 2026-04-06 15/750 2026-04-08 16:23 by luoyongfeng
[¿¼ÑÐ] 312Çóµ÷¼Á +4 Say Never 2026-04-04 4/200 2026-04-08 08:41 by barlinike
[¿¼ÑÐ] Ò»Ö¾Ô¸ËÕÖÝ´óѧ²ÄÁϹ¤³Ì£¨085601£©×¨Ë¶ÓпÆÑо­ÀúÈýÏî¹ú½±Á½¸öʵÓÃÐÍרÀûÒ»ÏîÊ¡¼¶Á¢Ïî +11 ´ó»ðɽС»ðɽ 2026-04-05 11/550 2026-04-06 22:55 by yunlongyang
[¿¼ÑÐ] 306·Ö²ÄÁÏÓ뻯¹¤Çóµ÷¼Á +7 Àè°ÉÀ²À²ÄãºÜÓÐà 2026-04-03 7/350 2026-04-05 17:18 by Hdyxbekcb
[¿¼ÑÐ] Ò»Ö¾Ô¸±±½»´ó²ÄÁϹ¤³Ì×Ü·Ö358Çóµ÷¼Á +6 cs0106 2026-04-05 6/300 2026-04-05 16:34 by imissbao
[¿¼ÑÐ] 0854Çóµ÷¼Á +4 assdll 2026-04-04 4/200 2026-04-05 09:44 by zhq0425
[¿¼ÑÐ] 085601£¬Ò»Ö¾Ô¸Ïôó334¸´ÊÔ±»Ë¢Çóµ÷¼Á +13 ÔøÑöÖ® 2026-04-03 15/750 2026-04-04 20:13 by dongzh2009
[¿¼ÑÐ] ²ÄÁϵ÷¼Á +11 ÎâèùÓ±£¡ 2026-04-03 11/550 2026-04-04 09:56 by ССÊ÷2024
[¿¼ÑÐ] 26µ÷¼Á 086003 +6 ʧ»îµÄϸ°û 2026-04-04 6/300 2026-04-04 09:50 by zhangdingwa
[¿¼ÑÐ] 294Çóµ÷¼Á +6 Grey_Ey 2026-04-03 6/300 2026-04-03 20:46 by ÐÀϲ777
ÐÅÏ¢Ìáʾ
ÇëÌî´¦ÀíÒâ¼û