²é¿´: 1142  |  »Ø¸´: 3

blacktea115

Òø³æ (СÓÐÃûÆø)


[½»Á÷] ¡¾ÇóÖú¡¿¹ØÓÚ¾§Ìåѧ±¨EµÄÉó¸åÒâ¼û£¬ÇóÖú¸ßÈË

ÍíÉÏÊÕµ½¾§Ìåѧ±¨EµÄ±à¼­µÄÉó¸åÒâ¼û£¬ÎÒÓÐÁ½ÌõÒâ¼û²»Ì«Ã÷°×£¬ÏëÇë½ÌһϾ§Ìå¸ßÊÖÃÇ
1.Even if long, in the case of Copper  the O1-Cu distance   d < 2.60 is an interactive (or at least border-line) distance and should be
included in the discussion, and the coordination could (and should!) be compared with similar ones in the literature.
ÎÒµÄO1-Cu ÊÇ2.59,±à¼­ÏëÒªÎұȽÏͬÀàµÄCu-O¼ü³¤Êǰɣ¬ÔÚCIFÎļþÀﲢûÓÐÕâ¸ö¼ü³¤°¡£¬»­³öÀ´µÄͼÀïҲûÓÐÕâ¸ö¼ü¡£platonÈí¼þÀïºÃÏñÁ¬ÉÏÁË¡£
d < 2.60 is an interactive (or at least border-line) distance and should be ncluded in the discussion,Õ߾仰ÊÇʲôÒâ˼¡£

2.Nothing is said about  the non-bonding interactions which, even if not strong (only non-conventional H-bonds are present) might have an important influence both in the molecular as in the packing conformations.
On the other hand Fig 2, without any discussion is absolutely irrelevant. In addition, as drawn  (in a fancy pespective fashion) the figure does not provide much insight on what is going on. A better view would be to show a parallel projection from infinity, so that a complete overlap of molecules occur, thus clarifying the view and allowing to show the essentials.
Îҵľ§ÌåûÓÐÇâ¼ü£¬±à¼­ÏëÈÃÎÒÌÖÂÛʲô¡£Fig2ÎÒ»­µÄÊǸö¾§±¨¶Ñ»ýͼ£¬µ«ÊÇÎÒûÓÐÃèÊöËü£¬ÊDz»ÊÇÒªÎÒÃèÊöһϡ£
In addition, as drawn  (in a fancy pespective fashion) the figure does not provide much insight on what is going on. A better view would be to show a parallel projection from infinity, so that a complete overlap of molecules occur, thus clarifying the view and allowing to show the essentials.Õâ¸ö¶«Î÷±à¼­ÏëÈÃÎÒÔõô»­°¡¡£

Çë¾§Ìå´ïÈËÖ¸µãһϣ¬Ð¡Ã÷dz£¸Ðл£¡

[ Last edited by blacktea115 on 2010-11-16 at 00:17 ]
»Ø¸´´ËÂ¥

» ²ÂÄãϲ»¶

» ±¾Ö÷ÌâÏà¹Ø¼ÛÖµÌùÍÆ¼ö£¬¶ÔÄúͬÑùÓаïÖú:

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

liyaoman4

ľ³æ (Ö°Òµ×÷¼Ò)


µÛ·ò:¸ÐлÄúµÄ»Ø¸´£¡ 2010-11-16 21:13:41
blacktea115(½ð±Ò+1): 2010-11-28 22:31:41
d < 2.60 is an interactive (or at least border-line) distance and should be included in the discussion,Õ߾仰ÊÇʲôÒâ˼¡£


±¾ÎÄÀ´×Ô: Сľ³æÂÛ̳ http://muchong.com/bbs/viewthread.php?tid=2598382&fpage=1  Òâ¼ûÊÇÄãµÄCu--O¼ü³¤Ð¡ÓÚ2.6   ÀíÂÛÉÏÄãÒª¶Ô¸Ã¼ü½øÐзÖÎöÌÖÂÛ£¬²¢ÒýÓÃÎÄÏ×¶ÔÕÕÂÛÖ¤£¬Èç¹û²»½âÊÍ£¬¸ø³öwhy£¡
2Â¥2010-11-16 11:25:13
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

jiangqibai

ľ³æ (ÕýʽдÊÖ)


Cu-O¼ü³¤¶Ì£¬Ó¦¸ÃÓÐÏ໥×÷Óà ÐèÒª¿¼ÂÇ£¡

µÛ·ò:¸ÐлÄúµÄ»Ø¸´£¡ 2010-11-16 21:13:47
blacktea115(½ð±Ò+1): 2010-11-28 22:31:48
±È½ÏÏà¹ØµÄÎÄÏ×£¡
3Â¥2010-11-16 19:46:32
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

lanmao20

½ð³æ (ÕýʽдÊÖ)


blacktea115(½ð±Ò+1): 2010-11-28 22:31:54
ßÀ£¬ÎÒÏëÄãÓ¦¸ÃÖØÐ»­ÕÅÆ¯ÁÁµãµÄͼ²¢ÇÒÕâÕÅͼӦ¸ÃÒª±íʾ³ö·½ÏòµÈ¡£¡£¡£
4Â¥2010-11-16 23:20:27
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû
Ïà¹Ø°æ¿éÌø×ª ÎÒÒª¶©ÔÄÂ¥Ö÷ blacktea115 µÄÖ÷Ìâ¸üÐÂ
×î¾ßÈËÆøÈÈÌûÍÆ¼ö [²é¿´È«²¿] ×÷Õß »Ø/¿´ ×îºó·¢±í
[˶²©¼ÒÔ°] ÊÛSCIÒ»ÇøÎÄÕ£¬ÎÒ:8.O.551.O.5.4,¿ÆÄ¿È«,¿ÉÙ¤¼± +3 0XLacIJUOj8D 2026-08-24 6/300 2026-08-25 00:11 by BZKMTicpDhFj
[»ù½ðÉêÇë] Ã÷ÌìÓ¦¸Ã¿É²éÁË£¡£¿ +5 chengyan1220 2026-08-23 5/250 2026-08-24 23:28 by ÎÒ4´ó°×²Ë
[»ù½ðÉêÇë] Èç¹û´Ë¿ÌÄãÕýÔÚΪ¹ú»ù¸Ðµ½½¹ÂÇ£¬²»·ÁÀ´ÌýÌýÕâÊס¶»ù½ðÖ®Íâ¡· +7 scalable 2026-08-24 7/350 2026-08-24 23:01 by anata1209
[ÂÛÎÄͶ¸å] ÊÛSCI-T0PÎÄÕ£¬ÎÒ:8O.5.5.1.O.54,¿ÆÄ¿ÆëÈ«,¿É+¼± +3 0XLacIJUOj8D 2026-08-24 3/150 2026-08-24 21:59 by BZKMTicpDhFj
[»ù½ðÉêÇë] ÈËÆø²»ÐÐÁË +10 fansofjerry 2026-08-21 10/500 2026-08-24 21:03 by zhanghaozhu
[»ù½ðÉêÇë] ÎÒÃæÉÏÍêµ°ÁË +9 ÇÒÌý»¢Ð¥ 2026-08-20 10/500 2026-08-24 20:08 by ¿àº®À´Ïã
[»ù½ðÉêÇë] ½ñÈÕ²»·Å°ñ£¿Íø´«¹ú×ÔȻԤ¼Æ 8 Ô 27 Èտɲé½á¹û +17 ҽѧÀÏÄк¢ 2026-08-20 21/1050 2026-08-24 14:21 by refreshing11
[»ù½ðÉêÇë] ·¶½øÖоÙÒ»ÎĵÄÖÐÐÄ˼Ïë +6 Ñ׻ƹóëÐ 2026-08-22 7/350 2026-08-24 11:58 by 6543yes
[»ù½ðÉêÇë] ÅóÓÑȦ¿´µ½µÄ +7 wangzilk 2026-08-18 9/450 2026-08-24 10:50 by cmrandy
[»ù½ðÉêÇë] ·Å°ñǰµÄ²»µ­¶¨ 20+4 snowwithsea 2026-08-19 17/850 2026-08-24 10:20 by echo8914667
[»ù½ðÉêÇë] ¿ÆÑй¶ùÌ«ÄÑÁË +18 ÎÒ4´ó°×²Ë 2026-08-20 19/950 2026-08-24 09:47 by ¿­¶÷¹ãÊ¢´ß»¯·ÖÎ
[»ù½ðÉêÇë] ʲôʱºò¿ª½±£¿ +10 CrisMessi 2026-08-18 11/550 2026-08-24 06:50 by ¿ªÐĵÄСʨ×Ó
[»ù½ðÉêÇë] 2026ÄêµÄ¹ú¼ÒÉç¿Æ»ù½ðÏîĿͨѶÆÀÉóµÄйæÔòÓëж¯Ïò¡¢ÐÂÌôÕ½ +4 process2012 2026-08-23 5/250 2026-08-23 19:58 by jurkat.1640
[½Ìʦ֮¼Ò] Ìø²ÛºóÔÚÑÐÏîÄ¿Ôõô°ì£¿ +5 ¼òµ¥»¯xn 2026-08-22 10/500 2026-08-23 12:38 by ¼òµ¥»¯xn
[»ù½ðÉêÇë] ½ñÌì·Å°ñÂ𣿠+15 ²¼²¼ºÍÒ»¶þ 2026-08-19 16/800 2026-08-23 09:55 by ÕÅ´ºÉú
[»ù½ðÉêÇë] Ö»ÓÐÿÄêÕâÖÖʱºòÀ´¹ä¹äСľ³æ +24 yaoyewhu2008 2026-08-20 26/1300 2026-08-22 17:43 by kammury
[»ù½ðÉêÇë] ½ñÌì»ù½ð»á³ö½á¹ûÂð£¿20260819 +16 kkkl_v 2026-08-19 17/850 2026-08-22 16:12 by °¢²¼Abu
[»ù½ðÉêÇë] ½ñÌì·Å°ñûϷÁ衃 +9 yuleib84 2026-08-19 11/550 2026-08-21 10:06 by gltch
[»ù½ðÉêÇë] »ù½ð°¡»ù½ð +4 longfie172 2026-08-20 4/200 2026-08-21 08:58 by mark mao
[»ù½ðÉêÇë] ½ñÌìά»¤ÏµÍ³Î¬»¤ ×£ËùÓÐÈË ¸ßÖÐ +8 gjjjzhong 2026-08-18 9/450 2026-08-18 13:01 by ¼ÒÓëÔ¶·½
ÐÅÏ¢Ìáʾ
ÇëÌî´¦ÀíÒâ¼û