A feasible set approach to the crystallographic phase problem

被引:45
|
作者
Marks, LD [1 ]
Sinkler, W [1 ]
Landree, E [1 ]
机构
[1] Northwestern Univ, Dept Mat Sci & Engn, Evanston, IL 60208 USA
来源
关键词
D O I
10.1107/S0108767398014408
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
The connection between the crystallographic phase problem and the feasible set approach is explored. It is argued that solving the crystallographic phase problem is formally equivalent to a feasible set problem using a statistical operator interpretable via a log-likelihood functional, projection onto the non-convex set of experimental structure factors coupled with a phase-extension constraint and mapping onto atomic positions. In no way does this disagree with or dispute any of the existing statistical relationships available in the literature; instead it expands understanding of how the algorithms work. Making this connection opens the door to the application of a number of well developed mathematical tools in functional analysis. Furthermore, a number of known results in image recovery can be exploited both to optimize existing algorithms and to develop new and improved algorithms.
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页码:601 / 612
页数:12
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