Excited-State Studies of Polyacenes: A Comparative Picture Using EOMCCSD, CR-EOMCCSD(T), Range-Separated (LR/RT)-TDDFT, TD-PM3, and TD-ZINDO-Reference-Cited by-同舟云学术

Excited-State Studies of Polyacenes: A Comparative Picture Using EOMCCSD, CR-EOMCCSD(T), Range-Separated (LR/RT)-TDDFT, TD-PM3, and TD-ZINDO

Published:2011-10-03 Issue:11 Volume:7 Page:3686-3693
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Lopata K.¹,Reslan R.²,Kowalska M.³,Neuhauser D.²,Govind N.¹,Kowalski K.¹

Affiliation:

1. William R. Wiley Environmental Molecular Sciences Laboratory, Pacific Northwest National Laboratory, Richland, Washington 99352, United States

2. Department of Chemistry and Biochemistry, University of California, Los Angeles, California 90095-1569, United States

3. Department of Chemistry, Washington State University Tri-Cities, Richland, Washington 99354, United States

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Link

https://pubs.acs.org/doi/pdf/10.1021/ct2005165

Reference59 articles.

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2. Organic light-emitting devices with saturated red emission using 6,13-diphenylpentacene

3. Functionalized Pentacene Derivatives for Use as Red Emitters in Organic Light-Emitting Diodes

4. Efficient single-layer “twistacene”-doped polymer white light-emitting diodes

5. Preparation and Spectral, Electrochemical, and Photovoltaic Properties of Acene-Modified Zinc Porphyrins

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