UV Absorption and Magnetic Circular Dichroism Spectra of Purine, Adenine, and Guanine: A Coupled Cluster Study in Vacuo and in Aqueous Solution-Reference-Cited by-同舟云学术

UV Absorption and Magnetic Circular Dichroism Spectra of Purine, Adenine, and Guanine: A Coupled Cluster Study in Vacuo and in Aqueous Solution

Published:2018-11-29 Issue:2 Volume:15 Page:1242-1254
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Khani Sarah Karbalaei¹²^ORCID,Faber Rasmus²^ORCID,Santoro Fabrizio³^ORCID,Hättig Christof¹^ORCID,Coriani Sonia²^ORCID

Affiliation:

1. Arbeitsgruppe Quantenchemie, Ruhr-Universität, Bochum D-44780, Germany

2. DTU Chemistry, Technical University of Denmark, Kemitorvet Build. 207, DK-2800 Kongens Lyngby, Denmark

3. Istituto di Chimica dei Composti Organo-Metallici, Consiglio Nazionale delle Ricerche (ICCOM-CNR), Area della Ricerca, via G. Moruzzi 1, I-56124 Pisa, Italy

Funder

Danmarks Tekniske Universitet

Det Frie Forskningsr?d

Deutsche Forschungsgemeinschaft

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.8b00930

Reference66 articles.

1. Nonradiative Decay Mechanisms in DNA Model Systems

2. Ultrafast Excited-State Dynamics in Nucleic Acids

3. DNA Excited-State Dynamics: From Single Bases to the Double Helix

4. Quantum Mechanical Studies on the Photophysics and the Photochemistry of Nucleic Acids and Nucleobases

5. Organic chemical applications of magnetic circular dichroism

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