±±¾©Ê¯ÓÍ»¯¹¤Ñ§Ôº2026ÄêÑо¿ÉúÕÐÉú½ÓÊÕµ÷¼Á¹«¸æ
²é¿´: 524  |  »Ø¸´: 5
µ±Ç°Ö÷ÌâÒѾ­´æµµ¡£

liminrui503

Òø³æ (СÓÐÃûÆø)

[½»Á÷] °ÝÇó£¬ÈçºÎ»Ø´ð¾§ÌåÀà´íÎ󡪡ªcheck low Ueq

PLAT242_ALERT_2_C Check Low       Ueq as Compared to Neighbors for         Cd

Éó¸åÈËÒâ¼û£º
10. Structure 2. ¡°Check Low Ueq as Compared to Neighbors for  Cd¡± indicates¡± wrong atom type, please check and comment. Are Cd-X distances OK?

ÔÚ¾§Ìå½á¹¹ÖÐCdÓëËĸößÁवªÔ­×ÓºÍÁ½·Ö×ÓË®Åä룬¼ü³¤·Ö±ðΪ£º
CdÖÜΧÅäλ¼ü¼ü³¤£º
Cd-O£º2.31
Cd-N£º2.34 and 2.36
¸öÈËÈÏΪÅäλ¼ü¶¼ÔÚºÏÊʵķ¶Î§ÄÚ£¬²»ÖªÔõôÓÃÓ¢ÎıíÊö£¬Çë½Ì¸ßÈËÈçºÎ»Ø´ð¡£
»Ø¸´´ËÂ¥
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

xi2004

ÖÁ×ðľ³æ (Ö°Òµ×÷¼Ò)

¡ï ¡ï ¡ï ¡ï ¡ï ¡ï ¡ï ¡ï ¡ï ¡ï ¡ï
liminrui503(½ð±Ò+10,VIP+0):ллÄú 1-8 10:06
huangxc8687(½ð±Ò+1,VIP+0):лл²ÎÓ룡 1-8 11:20
¼ÈÈ»È˼ÒÒѾ­Ìá³öÀ´ÁË, ×îºÃÊÇ×ö¸öÆäËû±íÕ÷Ö¤Ã÷Ò»ÏÂ.

ÁíÍâ,¿´¿´ÓëCdÅäλµÄÔ­×ÓUeqÊDz»ÊÇÓе㷴³£µØ´ó.
xi2004-emuch@163.com
2Â¥2010-01-08 09:31:24
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

liminrui503

Òø³æ (СÓÐÃûÆø)

лл

Xi2004ÀÏʦ£¬ÎÒ¸øÄú·¢ÁËÏûÏ¢£¬Âé·³Äú¿´Ò»ÏÂ
3Â¥2010-01-08 10:59:32
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

liminrui503

Òø³æ (СÓÐÃûÆø)

ллÄú

ÒýÓûØÌû:
Originally posted by xi2004 at 2010-1-8 09:31:
¼ÈÈ»È˼ÒÒѾ­Ìá³öÀ´ÁË, ×îºÃÊÇ×ö¸öÆäËû±íÕ÷Ö¤Ã÷Ò»ÏÂ.

ÁíÍâ,¿´¿´ÓëCdÅäλµÄÔ­×ÓUeqÊDz»ÊÇÓе㷴³£µØ´ó.

ÀÏʦ£¬ÎÒ¸øÄã·¢¶ÌÏûÏ¢ÁË£¬Âé·³Äú°ïÎÒ¿´¿´£¬Ð»Ð»ÄúÁË
4Â¥2010-01-08 11:15:18
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

dpzhang

ľ³æ (ÕýʽдÊÖ)

zhangwmwolf(½ð±Ò+0,VIP+0):¶àл²ÎÓë! 1-8 20:19
²»Ðеϰ¾ÍÏÞÖÆÒ»Ï°É
Éú»î»¹Òª¼ÌÐø
5Â¥2010-01-08 13:01:20
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

happypanda

½û³æ (СÓÐÃûÆø)

¡ï ¡ï
Сľ³æ(½ð±Ò+0.5):¸ø¸öºì°ü£¬Ð»Ð»»ØÌû½»Á÷
paopaomeng(½ð±Ò+1,VIP+0):лл½»Á÷ 1-10 09:43
±¾ÌûÄÚÈݱ»ÆÁ±Î

6Â¥2010-01-09 21:19:32
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû
Ïà¹Ø°æ¿éÌø×ª ÎÒÒª¶©ÔÄÂ¥Ö÷ liminrui503 µÄÖ÷Ìâ¸üÐÂ
×î¾ßÈËÆøÈÈÌûÍÆ¼ö [²é¿´È«²¿] ×÷Õß »Ø/¿´ ×îºó·¢±í
[¿¼ÑÐ] 266Çóµ÷¼Á +12 ÑôÑôÍÛÈû 2026-04-01 12/600 2026-04-03 10:31 by z648054048
[¿¼ÑÐ] 081200-11408-276ѧ˶Çóµ÷¼Á +6 ´Þwj 2026-04-02 6/300 2026-04-03 10:19 by À¶ÔÆË¼Óê
[¿¼ÑÐ] 085600 295·ÖÇóµ÷¼Á +19 W55j 2026-03-30 23/1150 2026-04-03 09:53 by ǧǧÔËÆø
[¿¼²©] É격ÇóÖú +3 Reee1Llll 2026-04-01 3/150 2026-04-02 22:29 by ÕâÊÇÒ»¸öÎÞÁĵÄê
[¿¼ÑÐ] ²ÄÁϵ÷¼Á +8 ÀÁÑòÑòÇáÖÃÓñÍÎ 2026-04-02 8/400 2026-04-02 22:03 by liu823948201
[¿¼ÑÐ] ²ÄÁϵ÷¼Á +7 Ò»ÑùYWY 2026-04-02 7/350 2026-04-02 21:49 by dongzh2009
[¿¼ÑÐ] ¿¼Ñе÷¼Á +3 Àîľ×Ó0120 2026-04-02 5/250 2026-04-02 21:45 by dongzh2009
[¿¼ÑÐ] 366Çóµ÷¼ÁÒ»Ö¾Ô¸¶«±±´óѧ +8 ÔËÆøÀ´µÃÈôÓÐËÆÎ 2026-04-02 8/400 2026-04-02 21:39 by dongzh2009
[¿¼ÑÐ] 085601Ò»Ö¾Ô¸±±Àí325·ÖÇóµ÷¼Á +4 ÕÒµ÷¼Á£¬£¬ 2026-04-02 4/200 2026-04-02 21:29 by dongzh2009
[¿¼ÑÐ] 343Çóµ÷¼Á085601 +5 ҪŬÁ¦Ñ§Ï°x 2026-03-29 6/300 2026-04-02 21:18 by 1104338198
[¿¼ÑÐ] µ÷¼Á +3 ºÃºÃ¶ÁÊé¡£ 2026-04-01 6/300 2026-04-02 15:49 by liumengping
[¿¼²©] ²ÄÁϹ¤³Ìרҵ˶ʿÉ격 +3 ÷ëÕýÓî 2026-03-30 3/150 2026-04-02 15:04 by greychen00
[¿¼ÑÐ] 279Çóµ÷¼Á +6 ѧ¶øË¼ÙâÖª 2026-04-01 6/300 2026-04-02 09:16 by vgtyfty
[¿¼ÑÐ] ²ÄÁϵ÷¼Á +12 Ò»ÑùYWY 2026-04-01 12/600 2026-04-02 00:21 by °ÙÃë¹âÄê
[¿¼ÑÐ] 311Çóµ÷¼Á +10 ÀîÜÆÐÂ1 2026-03-31 10/500 2026-04-01 14:38 by chenqifeng666
[¿¼ÑÐ] Ò»Ö¾Ô¸ ÄϾ©º½¿Õº½Ìì´óѧ £¬080500²ÄÁÏ¿ÆÑ§Ó빤³Ìѧ˶ +7 @taotao 2026-03-30 7/350 2026-04-01 14:30 by chenqifeng666
[¿¼ÑÐ] 070300»¯Ñ§354Çóµ÷¼Á +15 101´ÎÏ£Íû 2026-03-28 15/750 2026-03-31 17:58 by jp9609
[¿¼ÑÐ] Ò»Ö¾Ô¸´óÁ¬Àí¹¤´óѧ£¬»úе¹¤³Ìѧ˶£¬341 +3 Î÷¹ÏÌïµÄÊØÍûÕß 2026-03-30 3/150 2026-03-31 11:08 by asdfzly
[¿¼ÑÐ] 285Çóµ÷¼Á +6 AZMK 2026-03-29 9/450 2026-03-30 21:02 by dophin1985
[¿¼ÑÐ] 322Çóµ÷¼Á +10 ËÎÃ÷ÐÀ 2026-03-27 10/500 2026-03-30 18:47 by 544594351
ÐÅÏ¢Ìáʾ
ÇëÌî´¦ÀíÒâ¼û