Automatic determination of crystal structures using Karle–Hauptman matrices

作者: R. de Gelder , R. A. G. de Graaff , H. Schenk

DOI: 10.1107/S010876739200669X

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摘要: This paper describes a method for automatic structure determination by the application of Karle–Hauptman matrices to phase problem. A new method, common-minor strategy, is used combine information contained in several matrices. Sets phases large enough define are obtained. If linked properly, larger array can be adequately restricted common origin. The partial solutions obtained on Fourier transformation extended complete fully manner. algorithm presented maximization determinant matrix as function phases.

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