Works (3)

Updated: January 2nd, 2024 09:03

2020 journal article

Transferrable property relationships between magnetic exchange coupling and molecular conductance

CHEMICAL SCIENCE, 11(42), 11425–11434.

By: M. Kirk*, R. Dangi*, D. Habel-Rodriguez*, J. Yang*, D. Shultz n & J. Zhang n

TL;DR: It is found that the ratio of distance dependent decay constants for conductance and magnetic exchange coupling does not equal unity, indicating that inherent differences in the tunneling energy gaps, Δε, and the bridge–bridge electronic coupling, HBB, are not directly transferrable properties as they relate to exchange and conductance. (via Semantic Scholar)
Sources: Web Of Science, NC State University Libraries
Added: December 11, 2020

2017 journal article

Heterospin biradicals provide insight into molecular conductance and rectification

Chemical Science, 8(8), 5408–5415.

TL;DR: Properties of two isomeric triplet ground state biradical molecules, which serve as constant-bias analogs of single-molecule electronic devices, are described and experimental results are compared with transport calculations in a device geometry. (via Semantic Scholar)
Sources: Web Of Science, ORCID, NC State University Libraries, Crossref
Added: August 6, 2018

2015 journal article

Determining the Conformational Landscape of a and pi Coupling Using para-Phenylene and "Aviram-Ratner" Bridges

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 137(29), 9222–9225.

By: D. Stasiw n, J. Zhang n, G. Wang n, R. Dangi*, B. Stein*, D. Shultz n, M. Kirk*, L. Wojtas*, R. Sommer n

TL;DR: The torsional dependence of donor-bridge-acceptor (D-B-A) electronic coupling matrix elements and the pairwise exchange interactions are further illuminated in three-dimensional, "Ramachandran-type" plots that relate D-B and B-A torsions to both electronic and exchange couplings. (via Semantic Scholar)
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Sources: Web Of Science, NC State University Libraries
Added: August 6, 2018

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