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1.Concurrent determination of nanocrystal shape and amorphous phases in complex materials by diffraction scattering computed tomography

作者：Mie Elholm Birkbak ; Ida Gjerlevsen Nielsen ; Simon Frø ; lich ; Stuart R. Stock ; Peter Kenesei ; Jonathan D. Almer and Henrik Birkedal

关键词：diffraction scattering computed tomography ; nanocrystals ; amorphous phases ; Rietveld refinement

刊名：Journal of Applied Crystallography

出版年：2017

2.Activation of Dioxygen at a Lewis Acidic Nickel(II) Complex: Characterization of a Metastable Organoperoxide Complex

作者：Dr. Patrick Holze ; Teresa Corona ; Nicolas Frank ; Dr. Beatrice Braun-Cula ; Dr. Christian Herwig ; Dr. Anna Company and Prof. Dr. Christian Limberg

刊名：Angewandte Chemie

出版年：2017

3.Activation of Dioxygen at a Lewis Acidic Nickel(II) Complex: Characterization of a Metastable Organoperoxide Complex

作者：Dr. Patrick Holze ; Teresa Corona ; Nicolas Frank ; Dr. Beatrice Braun-Cula ; Dr. Christian Herwig ; Dr. Anna Company and Prof. Dr. Christian Limberg

刊名：Angewandte Chemie International Edition

出版年：2017

4.Ligand-forced dimerization of copper(I)-olefin complexes bearing a 1,3,4-thiadiazole core

作者：Bohdan Ardan ; Vasyl Kinzhybalo ; Yurii Slyvka ; Olga Shyyka ; Mykhaylo Luk`yanov ; Tadeusz Lis and Marian Mys`kiv

关键词：copper(I) ; &pi ; -complex13 ; 4-thiadiazole ; Hirshfeld surface analysis ; crystal structure ; electrochemical technique

刊名：Acta Crystallographica Section C

出版年：2017

5.Polymeric structure of a coproporphyrin I ruthenium(II) complex: a powder diffraction study

作者：Sergey V. Andreev ; Sergey A. Zverev ; Ilya A. Zamilatskov ; Nadezhda M. Kurochkina ; Gelii V. Ponomarev ; Andrew N. Fitch and Vladimir V. Chernyshev

关键词：coproporphyrin I ; ruthenium(II) complex ; one-dimensional coordination polymer ; synchrotron powder diffraction ; computational chemistry ; molecular cavity

刊名：Acta Crystallographica Section C

出版年：2017

6.Analytic expressions for the angular and the spectral fluxes at Compton X-ray sources

作者：M. Jacquet and C. Bruni

关键词：Compton scattering ; angular flux ; spectral flux ; electron beam ; divergence ; energy spread

刊名：Journal of Synchrotron Radiation

出版年：2017

7.A new one-dimensional Cu^II complex with a three-dimensional supramolecular architecture incorporating benzene-1,3-dicarboxylate and 1-[(1H-benzotriazol-1-yl)methyl]-1H-imidazole

作者：Jian-Hua Li ; Meng-Di Zhu and Qiu-Ying Huang

关键词：one-dimensional coordination polymer ; copper(II) complex ; crystal structure ; benzene-1 ; 3-dicarboxylate ; benzotriazole ; imidazole ; thermogravimetric analysis ; fluorescence behaviour

刊名：Acta Crystallographica Section C

出版年：2017

8.Computer simulations of X-ray six-beam diffraction in a perfect silicon crystal. II

作者：V. G. Kohn

关键词：X-ray diffraction ; silicon crystal ; six-beam diffraction ; section topography ; computer simulations

刊名：Acta Crystallographica Section A

出版年：2017

9.Solution of the structure of a calmodulin-peptide complex in a novel configuration from a variably twinned data set

作者：Jacob Pearson Keller

关键词：calmodulin complex ; hemihedral twinning ; merohedral twinning ; molecular replacement ; SAD phasing

刊名：Acta Crystallographica Section D

出版年：2017

10.WinPSSP: a revamp of the computer program PSSP and its performance solving the crystal structures of small organic compounds and solids of biological and pharmaceutical interest

作者：Silvina Pagola ; Alekos Polymeros and Nikolaos Kourkoumelis

关键词：powder diffraction ; direct-space methods ; crystal structure solution from powders ; simulated annealing ; global optimization ; computer programs

刊名：Journal of Applied Crystallography

出版年：2017

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