[RMCProfile-users] Question about using RMCprofile to fit XPDF
liuhui
liuhuichina at foxmail.com
Sun Apr 15 04:43:48 BST 2018
Dear all,
I am using Rmcprofile to fit my xPDF data. It has generated about 260000 moves, but I looked the box of supercell, there is only a few changes in the box. Besides, after lagre number moves there is no better fitting of the data. I do not know why? The attachment is the fitting result and required data.
Best,
Hui
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Hui Liu
Department of Physical Chemistry
University of Science and Technology Beijing
Beijing 100083, China
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