Nuclear velocity perturbation theory for vibrational circular dichroism: An approach based on the exact factorization of the electron-nuclear wave function-Reference-Cited by-同舟云学术

Nuclear velocity perturbation theory for vibrational circular dichroism: An approach based on the exact factorization of the electron-nuclear wave function

Published:2015-08-21 Issue:7 Volume:143 Page:074106
ISSN:0021-9606
Container-title:The Journal of Chemical Physics
language:en
Short-container-title:The Journal of Chemical Physics

Author:

Scherrer Arne¹²³^ORCID,Agostini Federica⁴^ORCID,Sebastiani Daniel¹^ORCID,Gross E. K. U.⁴,Vuilleumier Rodolphe²³

Affiliation:

1. Martin-Luther-University Halle-Wittenberg, von-Danckelmann-Platz 4, D-06120 Halle, Germany

2. UMR 8640 ENS-CNRS-UPMC, Département de Chimie, 24 rue Lhomond, École Normale Supérieure, 75005 Paris, France

3. UPMC Université Paris 06, 4, Place Jussieu, 75005 Paris, France

4. Max-Planck-Institute of Microstructure Physics, Weinberg 2, D-06120 Halle, Germany

Funder

European Commission

Deutsche Forschungsgemeinschaft (DFG)

Publisher

AIP Publishing

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://aip.scitation.org/doi/pdf/10.1063/1.4928578

Reference86 articles.

1. INFRARED AND RAMAN VIBRATIONAL OPTICAL ACTIVITY: Theoretical and Experimental Aspects

2. Vibrational circular dichroism

3. Vibrational Optical Activity

4. A second-order perturbation theory route to vibrational averages and transition properties of molecules: General formulation and application to infrared and vibrational circular dichroism spectroscopies

5. Toward Ab Initio Anharmonic Vibrational Circular Dichroism Spectra in the Condensed Phase

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