NMR Shielding Tensors and Chemical Shifts in Scalar-Relativistic Local Exact Two-Component Theory-Reference-Cited by-同舟云学术

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NMR Shielding Tensors and Chemical Shifts in Scalar-Relativistic Local Exact Two-Component Theory

Published:2019-01-08 Issue:2 Volume:15 Page:1028-1043
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Franzke Yannick J.¹,Weigend Florian²^ORCID

Affiliation:

1. Institute of Physical Chemistry, Karlsruhe Institute of Technology (KIT), Kaiserstraße 12, 76131 Karlsruhe, Germany

2. Institute of Nanotechnology, Karlsruhe Institute of Technology (KIT), Hermann-von-Helmholtz-Platz 1, 76344 Eggenstein-Leopoldshafen, Germany

Funder

Verband der Chemischen Industrie

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.8b01084

Reference168 articles.

1. Introduction to Relativistic Quantum Chemistry

2. Handbook of Relativistic Quantum Chemistry

3. Computational Methods in Lanthanide and Actinide Chemistry

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