Singlet‐Triplet Excited‐State Inversion in Heptazine and Related Molecules: Assessment of TD‐DFT and ab initio Methods
Author:
Affiliation:
1. Unité de Chimie Physique Théorique et Structurale & Laboratoire de Physique du Solid Namur Institute of Structured Matter Université de Namur B-5000 Namur Belgium
2. Department of Physical Chemistry University of Alicante E 03080 Alicante Spain
Publisher
Wiley
Subject
Physical and Theoretical Chemistry,Atomic and Molecular Physics, and Optics
Link
https://onlinelibrary.wiley.com/doi/pdf/10.1002/cphc.202000926
Reference77 articles.
1. Synthesis and structure of tri-s-triazine
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3. Corrugated layered heptazine-based carbon nitride: the lowest energy modifications of C3N4 ground state
4. Room Temperature Synthesis of Heptazine-Based Microporous Polymer Networks as Photocatalysts for Hydrogen Evolution
5. Donor-Acceptor-Type Heptazine-Based Polymer Networks for Photocatalytic Hydrogen Evolution
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