TD-DFT Benchmark on Inorganic Pt(II) and Ir(III) Complexes
Author:
Affiliation:
1. Scuola Normale Superiore, Piazza dei Cavalieri 7, 56126 Pisa, Italy
Funder
European Cooperation in Science and Technology
European Research Council
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry,Computer Science Applications
Link
https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.5b00257
Reference78 articles.
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4. Analyzing excited-state processes and optical signatures of a ratiomeric fluorine anion sensor: a quantum look
5. Combining the Bethe–Salpeter Formalism with Time-Dependent DFT Excited-State Forces to Describe Optical Signatures: NBO Fluoroborates as Working Examples
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