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Molecular Physics
An International Journal at the Interface Between Chemistry and Physics
Volume 111, 2013 - Issue 9-11: Special Issue: In Honour of Trygve Helgaker
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Invited Article

The bromine nuclear quadrupole moment revisited

Stella Stopkowicz Institut für Physikalische Chemie, Universität Mainz, Mainz, D-55099, Germany; Centre for Theoretical and Computational Chemistry, Department of Chemistry, University of Oslo, Oslo, N-0315, Norway
,
Lan Cheng Institut für Physikalische Chemie, Universität Mainz, Mainz, D-55099, Germany; Institute for Theoretical Chemistry, Department of Chemistry and Biochemistry, The University of Texas at Austin, Austin, TX, 78712, USA
,
Michael E. Harding Institut für Physikalische Chemie, Universität Mainz, Mainz, D-55099, Germany; Institut für Nanotechnologie, Karlsruher Institut für Technologie (KIT), Karlsruhe, D-76021, Germany
,
Cristina Puzzarini Dipartimento di Chimica ‘Giacomo Ciamician’, Università di Bologna, Via Selmi 2, Bologna, I-40126, Italy
&
Jürgen Gauss Institut für Physikalische Chemie, Universität Mainz, Mainz, D-55099, Germany
Pages 1382-1389 | Received 15 Feb 2013, Accepted 09 Apr 2013, Published online: 30 May 2013

Citations (8)

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Read on this site (1)

Pekka Pyykkö. (2018) Year-2017 nuclear quadrupole moments. Molecular Physics 116:10, pages 1328-1338.
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Articles from other publishers (7)

Beppo Hartwig, Melanie Schnell, Martin A. Suhm & Daniel A. Obenchain. (2024) Weak hydrogen bonding to halogens and chirality communication in propanols: Raman and microwave spectroscopy benchmark theory. Physical Chemistry Chemical Physics 26:12, pages 9432-9452.
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Xiao-Jun Sun, Chun-Xing Chen, Ning Wang & Hou-Bing Zhou. (2018) Systematic description of nuclear electric quadrupole moments. Chinese Physics C 42:12, pages 124105.
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Lan Cheng. (2015) Benchmark calculations on the nuclear quadrupole-coupling parameters for open-shell molecules using non-relativistic and scalar-relativistic coupled-cluster methods. The Journal of Chemical Physics 143:6.
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Lan Cheng, Stella Stopkowicz & Jürgen Gauss. (2014) Analytic energy derivatives in relativistic quantum chemistry. International Journal of Quantum Chemistry 114:17, pages 1108-1127.
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Stella Stopkowicz & Jürgen Gauss. (2014) Revised values for the nuclear quadrupole moments of and . Physical Review A 90:2.
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Rajat K. Chaudhuri, Sudip Chattopadhyay & Uttam Sinha Mahapatra. (2013) Reappraisal of Nuclear Quadrupole Moments of Atomic Halogens via Relativistic Coupled Cluster Linear Response Theory for the Ionization Process. The Journal of Physical Chemistry A 117:47, pages 12616-12627.
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Fang Wang, Timothy C. Steimle, Allan G. Adam, Lan Cheng & John F. Stanton. (2013) The pure rotational spectrum of ruthenium monocarbide, RuC, and relativistic ab initio predictions . The Journal of Chemical Physics 139:17.
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