Dissecting the concave-convex π-π interaction in corannulene and sumanene dimers: SAPT(DFT) analysis and performance of DFT dispersion-corrected methods-Reference-Cited by-同舟云学术

Dissecting the concave-convex π-π interaction in corannulene and sumanene dimers: SAPT(DFT) analysis and performance of DFT dispersion-corrected methods

Published:2017-10-26 Issue:2 Volume:39 Page:93-104
ISSN:0192-8651
Container-title:Journal of Computational Chemistry
language:en
Short-container-title:J. Comput. Chem.

Author:

Cabaleiro-Lago Enrique M.¹^ORCID,Fernández Berta²,Rodríguez-Otero Jesús³

Affiliation:

1. Department of Physical Chemistry; University of Santiago de Compostela, Avda. Alfonso X El Sabio s/n; Lugo 27001 Spain

2. Department of Physical Chemistry; University of Santiago de Compostela, Avda. das Ciencias s/n; Santiago de Compostela 15782 Spain

3. CIQUS and Facultade de Química (Dpto. de Química Física); Universidade de Santiago de Compostela; Santiago de Compostela Galicia 15782 Spain

Publisher

Wiley

Subject

Computational Mathematics,General Chemistry

Link

http://onlinelibrary.wiley.com/wol1/doi/10.1002/jcc.25084/fullpdf

Reference99 articles.

1. Chemical Science of π-Electron Systems

2. Supramolecular Chemistry

3. Toward complex matter: Supramolecular chemistry and self-organization

4. Supramolecular Chemistry

Cited by 14 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. Graphene Catalysis Made Easy;Comprehensive Computational Chemistry;2024

2. Orientation of Corannulenes inside Carbon Nanotubes;Advanced Theory and Simulations;2023-11-03

3. Investigating the effect of PDA/KH550 dual functionalized h-BCN nanosheets and hybrided with ZnO on corrosion and fouling resistance of epoxy coating: Experimental and DFT studies;Journal of Environmental Chemical Engineering;2022-12

4. Photoionization of buckybowls: Sumanene and derivatives;Journal of Photochemistry and Photobiology A: Chemistry;2022-03

5. Self-assembly of curved aromatic molecules in nanoparticles;Carbon;2021-09