Crystal Structure Refinement

出版者:Oxford University Press, USA

作者:Peter Müller

页数:232

出版时间:2006-09-07

价格:USD 140.00

装帧:Hardcover

isbn号码:9780198570769

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Crystal Structure Refinement is a mixture of textbook and tutorial. As A Crystallographers Guide to SHELXL it covers advanced aspects of practical crystal structure refinement, which have not been much addressed by textbooks so far. After an introduction to SHELXL in the first chapter, a brief survey of crystal structure refinement is provided. Chapters three and higher address the various aspects of structure refinement, from the treatment of hydrogen atoms to the assignment of atom types, to disorder, to non-crystallographic symmetry and twinning. One chapter is dedicated to the refinement of macromolecular structures and two short chapters deal with structure validation (one for small molecule structures and one for macromolecules). In each of the chapters the book gives refinement examples, based on the program SHELXL, describing every problem in detail. It comes with a CD-ROM with all files necessary to reproduce the refinements.

用户评价

第六章和第七章，讲晶修的基本过程很清楚。

第六章和第七章，讲晶修的基本过程很清楚。

第六章和第七章，讲晶修的基本过程很清楚。

第六章和第七章，讲晶修的基本过程很清楚。

第六章和第七章，讲晶修的基本过程很清楚。