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dongdong6930金虫 (正式写手)
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求助cif 文件一个A类错误5个B类错误
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PLAT113_ALERT_2_A ADDSYM Suggests Possible Pseudo/New Space-group. C2/m DIFMN02_ALERT_2_BThe minimum difference density is < -0.1*ZMAX*1.00 _refine_diff_density_min given = -3.811 Test value = -2.900 RINTA01_ALERT_3_B The value of Rint is greater than 0.18 Rint given 0.189 PLAT098_ALERT_2_B Large Reported Min. (Negative) Residual Density. -3.81 eA-3 PLAT110_ALERT_2_B ADDSYM Detects Potential Lattice Centering or Halving . ? PLAT112_ALERT_2_B ADDSYM Detects Additional (Pseudo) Symm. Elem... A -------------------------------------------------------------------------------- |
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3楼2009-08-04 15:36:52
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dongdong6930
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