Benchmarking Correlated Methods for Frequency-Dependent Polarizabilities: Aromatic Molecules with the CC3, CCSD, CC2, SOPPA, SOPPA(CC2), and SOPPA(CCSD) Methods-Reference-Cited by-同舟云学术

Benchmarking Correlated Methods for Frequency-Dependent Polarizabilities: Aromatic Molecules with the CC3, CCSD, CC2, SOPPA, SOPPA(CC2), and SOPPA(CCSD) Methods

Published:2020-04-17 Issue:5 Volume:16 Page:3006-3018
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Jørgensen Maria W.¹,Faber Rasmus²^ORCID,Ligabue Andrea³,Sauer Stephan P. A.¹^ORCID

Affiliation:

1. Department of Chemistry, University of Copenhagen, Copenhagen 2100, Denmark

2. Department of Chemistry, Technical University of Denmark, Kongens Lyngby 2800, Denmark

3. Game Science Research Center, University of Modena and Reggio Emilia, Modena 41121, Italy

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.9b01300

Reference75 articles.

1. Nonlinear optics in metamaterials

2. Dynamic polarizabilities and raman intensities of CO, N2, HCl and Cl2

3. Calculations of Polarizabilities and Their Gradients for Electron Energy-Loss Spectroscopy

4. A comparison of density functional theory and coupled cluster methods for the calculation of electric dipole polarizability gradients of methane

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