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Molecular Physics
An International Journal at the Interface Between Chemistry and Physics
Volume 110, 2012 - Issue 19-20: Special Issue in Honour of Peter R. Taylor
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Invited Articles

Atomic C6 dispersion coefficients: a four-component relativistic Kohn–Sham study

David Sulzer Laboratoire de Chimie Quantique, Institut de Chimie (UMR 7177), CNRS/Université de Strasbourg, 4 rue Blaise Pascal, 67000 Strasbourg, France
,
Patrick Norman Department of Physics, Chemistry and Biology, Linköping University, Linköping SE-581 83, Sweden
&
Trond Saue Laboratoire de Chimie et Physique Quantique (UMR 5626), CNRS/Université de Toulouse 3 (Paul Sabatier), 118 route de Narbonne, 31062 Toulouse, FranceCorrespondence[email protected]
Pages 2535-2541 | Received 10 Apr 2012, Accepted 30 Jun 2012, Published online: 10 Aug 2012

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Peter Schwerdtfeger & Jeffrey K. Nagle. (2019) 2018 Table of static dipole polarizabilities of the neutral elements in the periodic table. Molecular Physics 117:9-12, pages 1200-1225.
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Articles from other publishers (12)

Ravi Kumar, S. Chattopadhyay, D. Angom & B. K. Mani. (2021) Relativistic coupled-cluster calculation of the electric dipole polarizability and correlation energy of Cn, , and Og: Correlation effects from lighter to superheavy elements . Physical Review A 103:6.
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Trond Saue, Radovan Bast, André Severo Pereira Gomes, Hans Jørgen Aa. Jensen, Lucas Visscher, Ignacio Agustín Aucar, Roberto Di Remigio, Kenneth G. Dyall, Ephraim Eliav, Elke Fasshauer, Timo Fleig, Loïc Halbert, Erik Donovan Hedegård, Benjamin Helmich-Paris, Miroslav Iliaš, Christoph R. Jacob, Stefan Knecht, Jon K. Laerdahl, Marta L. Vidal, Malaya K. Nayak, Małgorzata Olejniczak, Jógvan Magnus Haugaard Olsen, Markus Pernpointner, Bruno Senjean, Avijit Shee, Ayaki Sunaga & Joost N. P. van Stralen. (2020) The DIRAC code for relativistic molecular calculations. The Journal of Chemical Physics 152:20.
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Giorgio Visentin & Alexei A. Buchachenko. (2019) Polarizabilities, dispersion coefficients, and retardation functions at the complete basis set CCSD limit: From Be to Ba plus Yb. The Journal of Chemical Physics 151:21.
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Lukas Konecny, Michal Repisky, Kenneth Ruud & Stanislav Komorovsky. (2019) Relativistic four-component linear damped response TDDFT for electronic absorption and circular dichroism calculations. The Journal of Chemical Physics 151:19.
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Xiaowei Sheng, Shifeng Qian & Fengfei Hu. (2017) Van der Waals potential and vibrational energy levels of the ground state radon dimer. Chemical Physics 493, pages 111-114.
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Thomas Fransson, Dirk R. Rehn, Andreas Dreuw & Patrick Norman. (2017) Static polarizabilities and C6 dispersion coefficients using the algebraic-diagrammatic construction scheme for the complex polarization propagator. The Journal of Chemical Physics 146:9.
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Stephen G. Dale & Erin R. Johnson. (2017) The ionic versus metallic nature of 2D electrides: a density-functional description. Phys. Chem. Chem. Phys. 19:40, pages 27343-27352.
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Stefan Grimme, Andreas Hansen, Jan Gerit Brandenburg & Christoph Bannwarth. (2016) Dispersion-Corrected Mean-Field Electronic Structure Methods. Chemical Reviews 116:9, pages 5105-5154.
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Thomas Fransson, Trond Saue & Patrick Norman. (2016) Four-Component Damped Density Functional Response Theory Study of UV/Vis Absorption Spectra and Phosphorescence Parameters of Group 12 Metal-Substituted Porphyrins. Journal of Chemical Theory and Computation 12:5, pages 2324-2334.
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Tiago Quevedo Teodoro, Roberto Luiz Andrade Haiduke, Umakanth Dammalapati, Steven Knoop & Lucas Visscher. (2015) The ground-state potential energy curve of the radium dimer from relativistic coupled cluster calculations. The Journal of Chemical Physics 143:8.
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Stefan Grimme. 2014. The Chemical Bond. The Chemical Bond 477 500 .
Julien Toulouse, Elisa Rebolini, Tim Gould, John F. Dobson, Prasenjit Seal & János G. Ángyán. (2013) Assessment of range-separated time-dependent density-functional theory for calculating C 6 dispersion coefficients . The Journal of Chemical Physics 138:19.
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