Improving the quality of diamond anvil cell data collected on an area detector by shading individual diamond overlaps

被引:12
作者
Casati, N. [1 ]
Macchi, P. [1 ]
Sironi, A. [1 ]
机构
[1] Univ Milan, DCSSI, I-20133 Milan, Italy
关键词
D O I
10.1107/S0021889807009843
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
Crystallographic data collected on a CCD using a diamond anvil cell may present overlapping diamond and sample reflections. These false intensities may not be rejected by common data processing programs and may affect the final hkl list. A utility was developed that shades these reflections during the integration, enabling their elimination before the solution or refinement. Moreover, this procedure avoids the error propagation to other reflections, caused by overlapping spots, through the profile fitting procedure of an integration run.
引用
收藏
页码:628 / 630
页数:3
相关论文
共 10 条
[1]   Absorption corrections for diamond-anvil pressure cells implemented in the software package -: Absorb6.0 [J].
Angel, RJ .
JOURNAL OF APPLIED CRYSTALLOGRAPHY, 2004, 37 :486-492
[2]   AN EMPIRICAL CORRECTION FOR ABSORPTION ANISOTROPY [J].
BLESSING, RH .
ACTA CRYSTALLOGRAPHICA SECTION A, 1995, 51 :33-38
[3]  
BRUKER, 1997, SMART VERSION 5 054
[4]  
Budzianowski A, 2004, NATO SCI SER II-MATH, V140, P101
[5]   Staggered to eclipsed conformational rearrangement of [Co2(CO)6(PPh3)2] in the solid state:: An X-ray diffraction study at high pressure and low temperature [J].
Casati, N ;
Macchi, P ;
Sironi, A .
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 2005, 44 (47) :7736-7739
[6]   Use of a CCD diffractometer in crystal structure determinations at high pressure [J].
Dawson, A ;
Allan, DR ;
Parsons, S ;
Ruf, M .
JOURNAL OF APPLIED CRYSTALLOGRAPHY, 2004, 37 :410-416
[7]   Shadowing and absorption corrections of single-crystal high-pressure data [J].
Katrusiak, A .
ZEITSCHRIFT FUR KRISTALLOGRAPHIE, 2004, 219 (08) :461-467
[8]   Characterization of the solid-solid phase transition of Co2(CO)6(AsPh3)2 [J].
Macchi, P ;
Garlaschelli, L ;
Martinengo, S ;
Sironi, A .
INORGANIC CHEMISTRY, 1998, 37 (24) :6263-6268
[9]  
Sheldrick G. M., 1997, SHELXL97
[10]  
SIEMENS, 1996, SADABS