²é¿´: 570  |  »Ø¸´: 12
µ±Ç°Ö»ÏÔʾÂú×ãÖ¸¶¨Ìõ¼þµÄ»ØÌû£¬µã»÷ÕâÀï²é¿´±¾»°ÌâµÄËùÓлØÌû

x»¨ÂúÂ¥

Òø³æ (СÓÐÃûÆø)

[ÇóÖú] ±à¼­ÎÊÌâ°¡

¸÷λ´óÏÀ£¬ÎÒµÄ Final R indices [I>2sigma(I)]     R1 = 0.0692, wR2 = 0.1144
  R indices (all data)              R1 = 0.1398, wR2 = 0.1426
µ«±à¼­ËµÊý¾Ýare of no particularly good quality. The data resolution should be increased (redundancy is too small) and the data should be measured at lower T (e.g. 200 K). The R-values are rather poor

ÎÒ¸ÃÔõô˵£¡£¡£¡
»Ø¸´´ËÂ¥
XXXXX
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

x»¨ÂúÂ¥

Òø³æ (СÓÐÃûÆø)

ÒýÓûØÌû:
5Â¥: Originally posted by pengw007 at 2012-08-30 17:59:50
theta_full»¹ºÃ,´óÓÚ25¾ÍÐÐÁË.¿ÉÄÜÊÇÆäËüÎÊÌâ°É.±à¼­¿ÉÄÜŪ´íÁËÊý¾Ý°É.

ËûÕâÑù˵µÄ
The reported single crystal data, especially that of structure 2, are of no particularly good quality. The data resolution should be increased (redundancy is too small) and the data should be measured at lower T (e.g. 200 K). The R-values are rather poor.
What kind of absorption correction was applied?
XXXXX
6Â¥2012-08-30 18:02:51
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû
²é¿´È«²¿ 13 ¸ö»Ø´ð

pengw007

Òø³æ (СÓÐÃûÆø)


¡ï
linhua0402313: ½ð±Ò+1, ¶÷£¬¸Ðл»ØÌû½»Á÷£¬»¶Ó­³£À´¾§Ìå°å¿é 2012-08-30 20:30:49
Ìù³ö
_diffrn_measured_fraction_theta_max    £¿
_diffrn_reflns_theta_full              £¿
_diffrn_measured_fraction_theta_full   £¿
_refine_diff_density_max    £¿
_refine_diff_density_min   £¿
_refine_diff_density_rms   £¿
Õâ¸ö²¿·ÖÀ´¿´¿´¡£
RÒò×ÓÊÇûÓÐÎÊÌâµÄ¡£
2Â¥2012-08-30 16:37:07
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

x»¨ÂúÂ¥

Òø³æ (СÓÐÃûÆø)

ÒýÓûØÌû:
2Â¥: Originally posted by pengw007 at 2012-08-30 16:37:07
Ìù³ö
_diffrn_measured_fraction_theta_max    £¿
_diffrn_reflns_theta_full              £¿
_diffrn_measured_fraction_theta_full   £¿
_refine_diff_density_max    £¿
_refine_diff_density_min   £¿
...

_diffrn_measured_fraction_theta_max    0.984
_diffrn_reflns_theta_full              26.80
_diffrn_measured_fraction_theta_full   0.984
_refine_diff_density_max    0.485
_refine_diff_density_min   -0.654
_refine_diff_density_rms    0.132
XXXXX
3Â¥2012-08-30 17:36:26
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû

x»¨ÂúÂ¥

Òø³æ (СÓÐÃûÆø)

ÒýÓûØÌû:
2Â¥: Originally posted by pengw007 at 2012-08-30 16:37:07
Ìù³ö
_diffrn_measured_fraction_theta_max    £¿
_diffrn_reflns_theta_full              £¿
_diffrn_measured_fraction_theta_full   £¿
_refine_diff_density_max    £¿
_refine_diff_density_min   £¿
...

ÊDz»ÊÇtheta_fullֵ̫СÁË
XXXXX
4Â¥2012-08-30 17:39:07
ÒÑÔÄ   »Ø¸´´ËÂ¥   ¹Ø×¢TA ¸øTA·¢ÏûÏ¢ ËÍTAºì»¨ TAµÄ»ØÌû
×î¾ßÈËÆøÈÈÌûÍÆ¼ö [²é¿´È«²¿] ×÷Õß »Ø/¿´ ×îºó·¢±í
[»ù½ðÉêÇë] ͶƱ:  ÓжàÉÙÈËÊǽñÌì²éϵͳ֪µÀ½á¹ûµÄ£¿ +15 °®¿´ÊéµÄ¿ÉÀÖ 2026-08-26 17/850 2026-08-27 03:31 by xxniao123
[»ù½ðÉêÇë] ¿´°åÉÏÕâô¶àÖеģ¬ÓеãÏñ50ÈËȺÀï49¸öÈ˶¼ÊÇÆ­×ÓµÄÄÇÖָоõ¡­¡­ +3 a089 2026-08-26 3/150 2026-08-26 23:21 by young90
[»ù½ðÉêÇë] ÎÒ²»Àí½â£¡ +15 Edward_pc 2026-08-26 23/1150 2026-08-26 20:34 by zzuzxg
[»ù½ðÉêÇë] ϵͳ²é²»µ½ +10 ¶­°Ëǧ 2026-08-26 10/500 2026-08-26 16:30 by Equinoxhua
[»ù½ðÉêÇë] 2026Äê8ÔÂ25ÈÕ¹ú×ÔÈ»·Å°ñǰͻȻÊÕµ½ÁÐÈëÆÀÉóר¼ÒÓʼþ£¬ÓйØÏµÂ𣿠+25 ľˮ˼¶¹ 2026-08-25 28/1400 2026-08-26 14:53 by draco1987
[»ù½ðÉêÇë] ÄÜ·ñÍ˳ö²ÎÓëµÄÃæÉÏÏîÄ¿½â³ýÏÞÏî +23 koalala 2026-08-24 26/1300 2026-08-26 14:29 by ±¦±´³æ×Ó
[»ù½ðÉêÇë] Ϊʲô¹ú×ÔÈ»²»ÄÜÖ±½Ó¹«²¼ +4 bjdxyxy 2026-08-26 4/200 2026-08-26 13:12 by qingmu1201
[»ù½ðÉêÇë] ¿ÆÑй¶ùÌ«ÄÑÁË +21 ÎÒ4´ó°×²Ë 2026-08-20 22/1100 2026-08-26 11:29 by nlgza
[»ù½ðÉêÇë] Ôõô¿´Çà»ùÖÐÁËûÓа¡ +4 Ò¶¾Å΢ 2026-08-26 4/200 2026-08-26 10:52 by xiacongxu
[»ù½ðÉêÇë] ½ñÌìÎñί»á¿ªÍêÁË£¬Ã÷Ìì³ö½á¹ûÂð +19 angus9576 2026-08-25 23/1150 2026-08-26 10:03 by zp519
[Ö°³¡ÈËÉú] ѧÉúײ¼û¸¨µ¼Ô±ËÍÍâÂô£¬µÚ¶þÌìÈ«°à¶¼³ÁĬÁË +3 ¾¨ÓãÈÚ½ð_Õã½­_É 2026-08-22 3/150 2026-08-26 09:01 by zzuzxg
[»ù½ðÉêÇë] ¹úºÏÏÖÔڲ鲻µ½ÁËÂ𣿠+10 chengyan1220 2026-08-24 20/1000 2026-08-26 08:57 by peasantsprig
[»ù½ðÉêÇë] Å£À´£¡Ã×À´£¡ÃæÀ´£¡ +8 beefly 2026-08-26 8/400 2026-08-26 08:37 by xuzhipiao
[»ù½ðÉêÇë] Èç¹û´Ë¿ÌÄãÕýÔÚΪ¹ú»ù¸Ðµ½½¹ÂÇ£¬²»·ÁÀ´ÌýÌýÕâÊס¶»ù½ðÖ®Íâ¡· +8 scalable 2026-08-24 8/400 2026-08-25 12:52 by jnhyjjm
[½Ìʦ֮¼Ò] µ¼Ê¦Í²ۣºÎÒÔõô̯ÉÏÁËÕâô¸ö¼«Æ·Ñо¿Éú£¡ +3 ËÕ¶«ÆÂ¶þÊÀ 2026-08-23 3/150 2026-08-25 10:35 by shisan1313
[»ù½ðÉêÇë] ÎÒÃæÉÏÍêµ°ÁË +13 ÇÒÌý»¢Ð¥ 2026-08-20 14/700 2026-08-25 09:10 by mrkang
[»ù½ðÉêÇë] ÈÃÎÒÖÐÒ»¸öÃæÉϰɣ¡ +13 ´óƼ1987 2026-08-20 16/800 2026-08-24 10:23 by ̫ɵÁË
[»ù½ðÉêÇë] ¿´À´½ñÌì²»»á·Å°ñÁË£¿ +8 chengyan1220 2026-08-21 11/550 2026-08-21 17:52 by dcqxinyang
[»ù½ðÉêÇë] ʱ¼ä´ÁÓÖ±äÁË +13 wuchongjun 2026-08-20 19/950 2026-08-21 17:21 by ×Ïɼ´¼
[»ù½ðÉêÇë] Ó¦¸ÃÊÇÏÂÖÜÈý26ÈÕ¹«²¼Á˰ɣ¿ +4 ¹þ¹þ¸ò£¿ 2026-08-21 4/200 2026-08-21 10:58 by Vivilian
ÐÅÏ¢Ìáʾ
ÇëÌî´¦ÀíÒâ¼û