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Remarks on X-ray Constrained/Restrained Wavefunction fitting

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Contributor : Alessandro Genoni Connect in order to contact the contributor
Submitted on : Wednesday, June 22, 2022 - 4:44:16 PM
Last modification on : Friday, June 24, 2022 - 3:41:12 AM


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Hans-Beat Bürgi, Alessandro Genoni. Remarks on X-ray Constrained/Restrained Wavefunction fitting. Acta Crystallographica Section B : Structural Science, Crystal Engineering and Materials [2014-..], International Union of Crystallography, 2022, 78 (3), pp.298 - 304. ⟨10.1107/s2052520622004164⟩. ⟨hal-03702033⟩



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