Znn3bq.jpeg
²é¿´: 1309  |  »Ø¸´: 7
µ±Ç°Ö»ÏÔʾÂú×ãÖ¸¶¨Ìõ¼þµÄ»ØÌû£¬µã»÷ÕâÀï²é¿´±¾»°ÌâµÄËùÓлØÌû

ÈÕ¹âÇã³Çecho

Òø³æ (СÓÐÃûÆø)

[ÇóÖú] ÇóÖú±½È²µÄ¼ÆËãÎÊÌ⣬ÈçºÎ¼ÆË㱽ȲµÄ×îÓŽṹÒÔ¼°µçºÉÃܶȡ£

×î½üÔÚ¼ÆËãһϼ׻ù±½È²µÄ×îÓŽṹ£¬Ïë¿´¿´ËüµÄÄÜÁ¿ÒÔ¼°µçºÉÃܶȣ¨ÓÈÆäÊÇÈý¼üÉϵĵçºÉÃܶȣ©£¬²»ÖªµÀÓÃʲô·½·¨±È½Ï׼ȷ£¬ÔÝʱÓõÄB3LYP/6-31g,µ«ÊÇÔÚÓÃgaussview»­½á¹¹Ê±Èçͼ1£¬¼ÆËãÍêÁËÖ®ºóÔÙ¿´Ê±×îÓŽṹ¾¹È»ÊǼױ½µÄ½á¹¹£¨Èçͼ2£©£¬¿ÉÎÒÕâ¸öÊǼ׻ù±½È²°¡£¬²»ÖªµÀÄÄÀï³öÁËÎÊÌ⣬¾ÍËãÊǵç×ÓÀëÓòÒ²²»Ó¦¸ÃÊǼױ½µÄ½á¹¹°¡£¬Çë´ó¼ÒÖ¸µãһϣ¡£¨±¾È˲»ÊÇ¸ã¼ÆËãµÄ£¬ÕæÊǸôÐÐÈç¸ôɽ°¡£©

1.jpg



2.jpg
»Ø¸´´ËÂ¥

» ²ÂÄãϲ»¶

» ±¾Ö÷ÌâÏà¹Ø¼ÛÖµÌùÍÆ¼ö£¬¶ÔÄúͬÑùÓаïÖú:

ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

ÈÕ¹âÇã³Çecho

Òø³æ (СÓÐÃûÆø)

ËÍÏÊ»¨Ò»¶ä
ÒýÓûØÌû:
6Â¥: Originally posted by jjww0001 at 2012-12-14 19:54:46
¿´¿´ÄÇ2¸öûÁ¬ÇâµÄcÖ®¼äµÄ¼ü³¤£¬³õʼ¹¹Ðͼü³¤µ÷ÕûµÄʱºòÖ»Òª¹Ø×¢Ò»ÏÂȲ¼ü£¬ÉÔ΢À­¶ÌÒ»µã£¬Ã»±ØÒªËùÓеͼµ÷ÕûµÄ£¬ÓÅ»¯¾ÍÊdzÌÐò×Ô¼ºµ÷Õû¹¹Ð͵Ĺý³Ì£¬gv»­µÄͼ²»±Ø¹ýÓÚ¾À½á£¬¼¸ÖؼüÍêÈ«ÊÇ¿ÉÒÔ×Ô¼º¸ÄµÄ£¬µçºÉÃܶÈÖ÷Òª»¹ ...

·Ç³£¸Ðл£¡
7Â¥2012-12-14 21:15:42
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû
²é¿´È«²¿ 8 ¸ö»Ø´ð

wangsihang

ľ³æ (ÕýʽдÊÖ)

¡¾´ð°¸¡¿Ó¦Öú»ØÌû

¡ï ¡ï ¡ï ¡ï ¡ï ¡ï ¡ï ¡ï
¸Ðл²ÎÓ룬ӦÖúÖ¸Êý +1
ÈÕ¹âÇã³Çecho: ½ð±Ò+8, ¡ï¡ï¡ïºÜÓаïÖú, 4 2012-12-14 10:21:24
¸ù¾ÝÄãµÄµÚÒ»¸ö½á¹¹£¬¸ß˹ÓÅ»¯Ê±ºòºÜ×ÔÈ»µÄ»áÓÅ»¯µ½×îÎȶ¨µÄ½á¹¹Ò²¾ÍÊǼױ½£¬ÒòΪËü²»ÖªµÀÄãµÄÊäÈëÎļþÊDZ½È²£¬Äã°ÑÄãµÄ¼ü³¤ÖØÐµ÷Õûһϰɡ£
2Â¥2012-12-13 20:48:26
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

ÈÕ¹âÇã³Çecho

Òø³æ (СÓÐÃûÆø)

ÒýÓûØÌû:
2Â¥: Originally posted by wangsihang at 2012-12-13 20:48:26
¸ù¾ÝÄãµÄµÚÒ»¸ö½á¹¹£¬¸ß˹ÓÅ»¯Ê±ºòºÜ×ÔÈ»µÄ»áÓÅ»¯µ½×îÎȶ¨µÄ½á¹¹Ò²¾ÍÊǼױ½£¬ÒòΪËü²»ÖªµÀÄãµÄÊäÈëÎļþÊDZ½È²£¬Äã°ÑÄãµÄ¼ü³¤ÖØÐµ÷Õûһϰɡ£

ÇëÎʵ÷Õû¼ü³¤Ê±ËùÓеÄÔ­×ÓÖ®¼äµÄ¼ü³¤¶¼ÒªÖØÐµ÷ÕûÂð£¿
3Â¥2012-12-14 10:21:17
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

wangsihang

ľ³æ (ÕýʽдÊÖ)

Èý½¨µÄ¼ü³¤Òªµ÷Õû£¬È»ºó±½»·µÄ¼ü³¤Ò²Òªµ÷Õû£¬ÒòΪ´Ëʱʵ¼ÊÉÏÒѾ­²»ÊÇÕæÕýÒâÒåÉϵı½»·ÁË¡£
4Â¥2012-12-14 11:45:10
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû
×î¾ßÈËÆøÈÈÌûÍÆ¼ö [²é¿´È«²¿] ×÷Õß »Ø/¿´ ×îºó·¢±í
[¿¼ÑÐ] µ÷¼Á +3 ÇàµÆ²»¸º 2026-04-09 3/150 2026-04-09 15:28 by ÊÍ·ÅÌìÐÔ
[¿¼ÑÐ] 274Çóµ÷¼Á +5 ɽ°¢Âû 2026-04-07 5/250 2026-04-09 15:28 by 18828373951
[¿¼ÑÐ] µ÷¼Á +12 ÔÂ@163.com 2026-04-08 12/600 2026-04-09 14:27 by rl1980
[¿¼ÑÐ] »¯Ñ§¹¤³Ìµ÷¼Á289 +36 yangæÃ 2026-04-07 37/1850 2026-04-09 14:10 by zxchoshi
[¿¼ÑÐ] »úеר˶273ÇëÇóµ÷¼Á +6 ¸ýÉêÈÉÉê 2026-04-07 6/300 2026-04-08 22:41 by bljnqdcc
[¿¼ÑÐ] ²ÄÁÏר˶(0856) 339·ÖÇóµ÷¼Á +16 ¹þ¹þ¹þ¶ì¹þ¹þ¹þ 2026-04-05 16/800 2026-04-08 16:02 by luoyongfeng
[¿¼ÑÐ] 263·ÖBÇøÇóµ÷¼Á +6 Àînihao 2026-04-08 6/300 2026-04-08 09:38 by ÄÏ¿ªÐ¡ôë
[¿¼ÑÐ] ÉúÎ﹤³ÌÇóµ÷¼Á +13 ϲ»¶»¹ÊDz»¸ÊÐÄ 2026-04-05 13/650 2026-04-07 16:55 by Ecowxq666£¡
[¿¼ÑÐ] ²ÄÁϵ÷¼Á +11 Ò»ÑùYWY 2026-04-07 11/550 2026-04-07 15:13 by shdgaomin
[¿¼ÑÐ] 22408 318·ÖÇóµ÷¼Á +4 ÇڷܵÄСÁý°ü 2026-04-06 6/300 2026-04-07 15:05 by Ö½º×555
[¿¼ÑÐ] 080500Çóµ÷¼Á +12 »ÆÓ 2026-04-06 12/600 2026-04-07 12:41 by upczlm1989
[¿¼ÑÐ] 372·Ö²ÄÁÏÓ뻯¹¤£¨085600£©Ó¢¶þÊý¶þÇóµ÷¼Á +4 À¶¼ãƬ 2026-04-06 4/200 2026-04-07 12:30 by dongzh2009
[¿¼ÑÐ] 26×ÔÈ»µØÀíѧ303·ÖÇóµ÷¼Á +4 Ò»Õ½³É˶°¡°¡°¡° 2026-04-06 9/450 2026-04-06 20:35 by lin-da
[¿¼ÑÐ] ¸´ÊÔµ÷¼Á +5 asdasdassda 2026-04-05 5/250 2026-04-06 09:32 by dongzh2009
[¿¼ÑÐ] 295Çóµ÷¼Á +4 AÄãºÃÑо¿Éú 2026-04-04 5/250 2026-04-04 22:46 by yu221
[¿¼ÑÐ] Çóµ÷¼Á +4 êɹ¦? 2026-04-03 4/200 2026-04-04 21:58 by hemengdong
[¿¼ÑÐ] 359Çóµ÷¼Á +7 hhhhaaaa$ 2026-04-04 7/350 2026-04-04 18:49 by imissbao
[¿¼ÑÐ] ¸´ÊÔµ÷¼Á +6 ·¶¸ùÅà 2026-04-04 6/300 2026-04-04 14:27 by ÍÁľ˶ʿÕÐÉú
[¿¼ÑÐ] 387Çóµ÷¼Á +4 °®³ÔƬ¶¹ÍÁ 2026-04-03 5/250 2026-04-04 08:10 by °¶ÉϵÄÒ»ÌõÓã
[¿¼ÑÐ] 335Çóµ÷¼Á +7 ÉòÇåÁ§ 2026-04-03 7/350 2026-04-03 18:55 by lijunpoly
ÐÅÏ¢Ìáʾ
ÇëÌî´¦ÀíÒâ¼û