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Measurements of Long-range Electronic Correlations During Femtosecond Diffraction Experiments Performed on Nanocrystals of Buckminsterfullerene
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When combined X-ray and polarized neutron diffraction data challenge high-level calculations: spin-resolved electron

Ariste Bolivard Voufack1, Nicolas Claiser1, Claude Lecomte1

  • 1Université de Lorraine, Laboratoire CRM2, UMR CNRS 7036, Boulevard des aiguillettes BP70239, 54506 Vandoeure-les-Nancy, France.

Acta Crystallographica Section B, Structural Science, Crystal Engineering and Materials
|August 2, 2017
PubMed

Keywords:
DFT and CASSCF calculationsX-ray and polarized neutron diffractioncharge and spin densitiesjoint refinementnitronyl nitroxide free radical

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