±±¾©Ê¯ÓÍ»¯¹¤Ñ§Ôº2026ÄêÑо¿ÉúÕÐÉú½ÓÊÕµ÷¼Á¹«¸æ
²é¿´: 816  |  »Ø¸´: 2

B612

°æÖ÷

ÓÅÐ㣡£¡ÓÐľÓУ¡£¡£¡ÓÅÐ㣡£¡ÓÐľÓУ¡£¡£¡ÓÅÐ㣡£¡ÓÐľÓУ¡£¡£¡ÓÅÐ㣡£¡ÓÐľÓУ¡£¡£¡

[ÇóÖú] Çóovgf

¸÷λ³æÓÑ£¬´ó¼ÒºÃ£¡ÏëÇë½Ì´ó¼ÒÒ»¸öÎÊÌ⣺OVGF¼ÆËãµçÀëÄܵľßÌå·½·¨£¬ºÙºÙ...Ô½¾ßÌåÔ½ºÃŶ£¡ÓÐ×ÊÁϵϰÇó¹²Ïí¡£Îޱȸм¤...
»Ø¸´´ËÂ¥
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

nwwolfchj

°æÖ÷

ÓÅÐ㣡£¡ÓÐľÓУ¡£¡£¡ÓÅÐ㣡£¡ÓÐľÓУ¡£¡£¡ÓÅÐ㣡£¡ÓÐľÓУ¡£¡£¡ÓÅÐ㣡£¡ÓÐľÓУ¡£¡£¡

¡¾´ð°¸¡¿Ó¦Öú»ØÌû

¡ï ¡ï
¸Ðл²ÎÓ룬ӦÖúÖ¸Êý +1
gmy1990: ½ð±Ò+2 2012-06-03 10:28:14
http://www.cfs.dl.ac.uk/docs/html/part2/node29.html    GAMESS-UKµÄ
http://www.auburn.edu/cosam/facu ... search/ept_g03.html   GaussianµÄOVGF×÷ÕßOritz
ÁíÍâ MOPACÔçÆÚµÄ°æ±¾Óа뾭Ñé½áºÏµÄOVGF, ÏÖÔÚ°æ±¾ÓÐûÓв»ÏþµÃ. http://www.cache.fujitsu.com/mopac/Mopac2002manual/node472.html
Óй«¿ª³ÌÐòµÄËÆºõÒ²¾ÍÕâô¶à.
2Â¥2012-06-03 09:44:09
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

B612

¹ÜÀíÔ±

ÓÅÐ㣡£¡ÓÐľÓУ¡£¡£¡ÓÅÐ㣡£¡ÓÐľÓУ¡£¡£¡ÓÅÐ㣡£¡ÓÐľÓУ¡£¡£¡ÓÅÐ㣡£¡ÓÐľÓУ¡£¡£¡

ÒýÓûØÌû:
2Â¥: Originally posted by nwwolfchj at 2012-06-03 09:44:09
http://www.cfs.dl.ac.uk/docs/html/part2/node29.html    GAMESS-UKµÄ
http://www.auburn.edu/cosam/faculty/chemistry/ortiz/research/ept_g03.html   GaussianµÄOVGF×÷ÕßOritz
ÁíÍâ MOPACÔçÆÚµÄ°æ±¾Óа뾭Ñé½á ...

лл£¬Ì«¸Ð¼¤ÄãÀ²
3Â¥2012-06-03 11:09:59
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû
Ïà¹Ø°æ¿éÌø×ª ÎÒÒª¶©ÔÄÂ¥Ö÷ B612 µÄÖ÷Ìâ¸üÐÂ
×î¾ßÈËÆøÈÈÌûÍÆ¼ö [²é¿´È«²¿] ×÷Õß »Ø/¿´ ×îºó·¢±í
[¿¼ÑÐ] 270Çóµ÷¼Á +4 С½Üpp 2026-03-31 5/250 2026-04-01 19:06 by ¿Í¶ûÃÀµÂ
[¿¼ÑÐ] »¯Ñ§¹¤³Ìר˶324·Ö£¬Ò»Ö¾Ô¸Öйú¿óÒµ´óѧÇóµ÷¼Á +3 ¹¢¹¢1314 2026-04-01 3/150 2026-04-01 19:04 by CFQZAFU
[¿¼ÑÐ] 286·Öµ÷¼Á +15 Faune 2026-03-30 17/850 2026-04-01 17:58 by ¸øÄãÄã×¢ÒâÐÝÏ¢
[¿¼ÑÐ] ²ÄÁϵ÷¼Á +6 Ò»ÑùYWY 2026-04-01 6/300 2026-04-01 17:00 by fch1983
[¿¼ÑÐ] 0703»¯Ñ§/290Çóµ÷¼Á/±¾¿Æ¾­Àú·á¸»/¹¤¿ÆÒ²¿É +14 µ¤ÇàÄÌ¸Ç 2026-03-26 16/800 2026-04-01 15:58 by oooqiao
[¿¼ÑÐ] 285Çóµ÷¼Á +5 FZAC123 2026-03-30 5/250 2026-04-01 15:50 by º«Ó꺭
[¿¼ÑÐ] 0856³õÊÔ324·ÖÇóµ÷¼Á +5 ÏëÉÏѧÇóµ÷ 2026-04-01 5/250 2026-04-01 15:28 by ¿¼ÑÐÉϰ¶Ñ½Ò»¶¨Ò
[¿¼ÑÐ] 302Çóµ÷¼ÁÒ»Ö¾Ô¸±±º½070300£¬±¾¿ÆÖ£´ó»¯Ñ§ +8 Ê¥ÈÕ¶úÂüÌõ 2026-04-01 10/500 2026-04-01 14:03 by ZXlzxl0425
[¿¼ÑÐ] ²ÄÁÏÓ뻯¹¤µ÷¼ÁÒ»Ö¾Ô¸´óÁ¬º£ÊÂ085600£¬349 +9 ³ÔµÄ²»ÉÙ 2026-03-30 9/450 2026-04-01 11:24 by wangjy2002
[¿¼ÑÐ] Çóµ÷¼Á£¬Ò»Ö¾Ô¸ ÄϾ©º½¿Õº½Ìì´óѧ £¬080500²ÄÁÏ¿ÆÑ§Ó빤³Ìѧ˶£¬×Ü·Ö289·Ö +10 @taotao 2026-03-29 10/500 2026-04-01 09:30 by oooqiao
[¿¼ÑÐ] µ÷¼ÁÉêÇë +8 ÕÅÕÅÕÅÕÅzy 2026-03-31 9/450 2026-04-01 08:29 by zjbkx
[¿¼ÑÐ] Çóµ÷¼Á ÉúÎïѧ 377·Ö +6 zzll03 2026-03-31 6/300 2026-03-31 17:33 by ÌÆãå¶ù
[¿¼ÑÐ] ±¾¿Æ211ÉúÎïҽѧ¹¤³Ì085409Çóµ÷¼Á339·Ö +7 Àï×Óľyy 2026-03-29 7/350 2026-03-31 14:35 by fmesaito
[¿¼ÑÐ] 297 µØÀíѧ070500 ¸´ÊÔÇóµ÷¼Á +3 СԲȦȦooo 2026-03-30 3/150 2026-03-30 21:05 by ÓàÕðyz
[¿¼ÑÐ] 304²ÄÁÏÇóµ÷¼Á +5 ÖÓllll 2026-03-26 5/250 2026-03-30 19:37 by Ô´_2020
[¿¼ÑÐ] 317·Ö Ò»Ö¾Ô¸ÄÏÀí¹¤²ÄÁϹ¤³Ì ±¾¿Æºþ¹¤´ó Çóµ÷¼Á +12 ÓóÄàСÁåîõ 2026-03-28 12/600 2026-03-30 17:06 by wangjy2002
[¿¼ÑÐ] 342Çóµ÷¼Á +4 ¼ÓÓÍaÀîzs 2026-03-26 4/200 2026-03-30 16:39 by ¾§ÌåÖ®ÃÀ
[¿¼ÑÐ] 296Çóµ÷¼Á +10 ±Ë°¶t 2026-03-29 10/500 2026-03-30 10:50 by ̽123
[¿¼ÑÐ] µ÷¼Á¿¼ÑÐ +3 Íõ½ÜÒ» 2026-03-29 3/150 2026-03-29 08:09 by fmesaito
[¿¼ÑÐ] 352·Ö »¯¹¤Óë²ÄÁÏ +5 º£Äɰٴ¨Ly 2026-03-27 5/250 2026-03-28 03:39 by fmesaito
ÐÅÏ¢Ìáʾ
ÇëÌî´¦ÀíÒâ¼û