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DiffPy-CMI tutorial files for the ADD2019 workshop, ILL, Grenoble
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01-Structure-Representation.ipynb
02-Function-Calculators.ipynb
03-SrFit-demo-constraints-restraints.ipynb
04-SrFit-two-datasets.ipynb
05-Fit-NaCl-BVS-restraint.ipynb
06-Fit-CdSe-nanoparticle.ipynb
08-Orient-Naphthalene.ipynb
09-Magnetic-PDF.ipynb
10-NPDF-Fit-twothetazero.ipynb
99-problems.ipynb
99-solutions.ipynb
Au.cif
CdSe.gr
CdSe_T5.xyz
CdSe_zinc-blende.cif
MnO_struc.stru
MnOfit_PDFgui.fgr
NaCl.cif
NaCl.gr
Ni-9008476.cif
Ni-q27r60-xray.gr
Ni.cif
README.md
TiO2_rutile.cif
cdse_functions.py
naphthalene.cif
naphthalene.gr
naphthalene_functions.py
ni_755tthM.dat
quinacridone-beta.cif

README.md

DiffPy-CMI tutorial

Example Jupyter notebooks and data files for the DiffPy-CMI tutorial at the ADD 2019 conference.

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