Validation of X‐ray Wavefunction Refinement-Reference-Cited by-同舟云学术

Validation of X‐ray Wavefunction Refinement

Published:2017-11-23 Issue:23 Volume:18 Page:3334-3351
ISSN:1439-4235
Container-title:ChemPhysChem
language:en
Short-container-title:ChemPhysChem

Author:

Woińska Magdalena¹,Jayatilaka Dylan²,Dittrich Birger³^ORCID,Flaig Ralf⁴,Luger Peter⁵,Woźniak Krzysztof¹^ORCID,Dominiak Paulina M.¹^ORCID,Grabowsky Simon⁶^ORCID

Affiliation:

1. Biological and Chemical Research Centre, Chemistry Department University of Warsaw Zwirki i Wigury 101 02-089 Warsaw Poland

2. School of Molecular Sciences The University of Western Australia 35 Stirling Highway Perth WA 6009 Australia

3. Heinrich-Heine-Universität Düsseldorf Anorganische Chemie und Strukturchemie Gebäude 26.42.01.21, Universitätsstraße 1 40225 Düsseldorf Germany

4. Diamond Light Source Harwell Science and Innovation Campus Didcot, Oxon OX11 0DE UK

5. Freie Universität Berlin Institut für Chemie und Biochemie Fabeckstraße 36a 14195 Berlin Germany

6. Institut für Anorganische Chemie und Kristallographie, Fachbereich 2-Biologie/Chemie Universität Bremen Leobener Straße NW2 28359 Bremen Germany

Funder

Deutsche Forschungsgemeinschaft

Australian Research Council

Narodowe Centrum Nauki

Publisher

Wiley

Subject

Physical and Theoretical Chemistry,Atomic and Molecular Physics, and Optics

Link

https://onlinelibrary.wiley.com/doi/pdf/10.1002/cphc.201700810

Reference104 articles.

1. Quantum crystallography and the use of kernel projector matrices

2. Quantum crystallography applied to crystalline maleic anhydride

3. Quantum crystallography

4. Can X-ray constrained Hartree–Fock wavefunctions retrieve electron correlation?

5. Importance of Relativistic Effects and Electron Correlation in Structure Factors and Electron Density of Diphenyl Mercury and Triphenyl Bismuth

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