@article{ec4541f08f924bbc8a7084588afbd49b,
title = "Magnetic coupling in a hybrid Mn(II) acetylene dicarboxylate",
abstract = "The design of ligands that mediate through-bond long range super-exchange in metal-organic hybrid materials would expand chemical space beyond the commonly observed short range, low temperature magnetic ordering. Here we examine acetylene dicarboxylate as a potential ligand that could install long range magnetic ordering due to its spatially continuous frontier orbitals. Using a known Mn(II)-containing coordination polymer we compute and measure the electronic structure and magnetic ordering. In this case, the latter is weak owing to the sub-optimal ligand coordination geometry, with a critical temperature of 2.5 K.",
author = "Hendon, {Christopher H.} and Fabienne Pradaux-Caggiano and Hatcher, {Lauren E.} and Gee, {William J.} and Wilson, {Chick C.} and Butler, {Keith T.} and Carbery, {David R.} and Aron Walsh and Melot, {Brent C.}",
note = "Funding Information: BCM gratefully acknowledges support from the Office of Naval Research Grant # N00014-15-1-2411. The work at the University of Bath benefited by financial support from EPSRC (Grants EP/I033459/1, EP/J017361/1, EP/K004956/1WK, EP/ M009580/1, EP/L000202), the Royal Society, the ERC (Grant 277757) and the Leverhulme Trust. This work used the Extreme Science and Engineering Discovery Environment (XSEDE), which is supported by National Science Foundation grant number ACI-1053575. Publisher Copyright: {\textcopyright} 2016 The Owner Societies.",
year = "2016",
doi = "10.1039/C6CP06886C",
language = "English",
volume = "18",
pages = "33329--33334",
journal = "Physical Chemistry Chemical Physics",
issn = "1463-9076",
publisher = "Royal Society of Chemistry",
number = "48",
}