Theory and algorithms for chiroptical properties and spectroscopies of aqueous systems-Reference-Cited by-同舟云学术

Theory and algorithms for chiroptical properties and spectroscopies of aqueous systems

Published:2020 Issue:40 Volume:22 Page:22864-22879
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Giovannini Tommaso¹²³⁴^ORCID,Egidi Franco⁵⁶⁷^ORCID,Cappelli Chiara⁵⁶⁷^ORCID

Affiliation:

1. Department of Chemistry

2. Norwegian University of Science and Technology (NTNU)

3. 7491 Trondheim

4. Norway

5. Scuola Normale Superiore

6. I-56126 Pisa

7. Italy

Abstract

We review an atomistic, fully polarizable approach to accurately predict the chiroptical properties of molecular systems in aqueous solution, by retaining all relevant physico-chemical interactions.

Funder

Norges Forskningsråd

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2020/CP/D0CP04027D

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