Static polarizabilities and C6 dispersion coefficients using the algebraic-diagrammatic construction scheme for the complex polarization propagator-Reference-Cited by-同舟云学术

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Static polarizabilities and C6 dispersion coefficients using the algebraic-diagrammatic construction scheme for the complex polarization propagator

Published:2017-03-07 Issue:9 Volume:146 Page:094301
ISSN:0021-9606
Container-title:The Journal of Chemical Physics
language:en
Short-container-title:The Journal of Chemical Physics

Author:

Fransson Thomas¹^ORCID,Rehn Dirk R.²,Dreuw Andreas³,Norman Patrick²^ORCID

Affiliation:

1. Stanford PULSE Institute, SLAC National Accelerator Laboratory, Menlo Park, California 94025, USA

2. Department of Theoretical Chemistry and Biology, School of Biotechnology, Royal Institute of Technology, SE-10691 Stockholm, Sweden

3. Interdisciplinary Center for Scientific Computing, University of Heidelberg, Im Neuenheimer Feld 205, 69120 Heidelberg, Germany

Funder

Human Frontier Science Program (HFSP)

European Cooperation in Science and Technology (COST)

Knut och Alice Wallenbergs Stiftelse (Knut and Alice Wallenberg Foundation)

Svenska Forskningsrådet Formas (Swedish Research Council Formas)

Publisher

AIP Publishing

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://aip.scitation.org/doi/pdf/10.1063/1.4977039

Reference94 articles.

1. A perspective on nonresonant and resonant electronic response theory for time-dependent molecular properties

2. Beyond the random-phase approximation: A new approximation scheme for the polarization propagator

3. Algebraic-diagrammatic construction propagator approach to molecular response properties

4. Perspective: Advances and challenges in treating van der Waals dispersion forces in density functional theory

5. Benchmarking of London Dispersion-Accounting Density Functional Theory Methods on Very Large Molecular Complexes

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1. Efficient and Parallel Implementation of Real and Complex Response Functions Employing the Second-Order Algebraic-Diagrammatic Construction Scheme for the Polarization Propagator;Journal of Chemical Theory and Computation;2023-12-20

2. Cotton-Mouton Effect Using Algebraic Diagrammatic Construction Schemes in the Intermediate State Representation Formalism;The Journal of Physical Chemistry A;2023-10-10

3. responsefun: Fun with Response Functions in the Algebraic Diagrammatic Construction Framework;Journal of Chemical Theory and Computation;2023-09-07

4. Efficient Protocol for Computing MCD Spectra in a Broad Frequency Range Combining Resonant and Damped CC2 Quadratic Response Theory;Journal of Chemical Theory and Computation;2023-08-31

5. Consistent third-order one-particle transition and excited-state properties within the algebraic-diagrammatic construction scheme for the polarization propagator;The Journal of Chemical Physics;2023-07-05

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