Materials Map

Discover the materials research landscape. Find experts, partners, networks.

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The Materials Map is an open tool for improving networking and interdisciplinary exchange within materials research. It enables cross-database search for cooperation and network partners and discovering of the research landscape.

The dashboard provides detailed information about the selected scientist, e.g. publications. The dashboard can be filtered and shows the relationship to co-authors in different diagrams. In addition, a link is provided to find contact information.

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The Materials Map is still under development. In its current state, it is only based on one single data source and, thus, incomplete and contains duplicates. We are working on incorporating new open data sources like ORCID to improve the quality and the timeliness of our data. We will update Materials Map as soon as possible and kindly ask for your patience.

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University of Bath

in Cooperation with on an Cooperation-Score of 37%

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Publications (5/5 displayed)

  • 2020Understanding CO2/CH4Separation in Pristine and Defective 2D MOF CuBDC Nanosheets via Nonequilibrium Molecular Dynamics40citations
  • 2018Enhancement of CO2 uptake and selectivity in a metal-organic framework by incorporation of thiophene functionality61citations
  • 2015Metal-organic frameworks from divalent metals and 1,4-benzenedicarboxylate with bidentate pyridine-N-oxide co-ligands19citations
  • 2015Metal–Organic Frameworks from Divalent Metals and 1,4-Benzenedicarboxylate with Bidentate Pyridine- N -oxide Co-ligands19citations
  • 2014Polymorphism of metal-organic frameworks47citations

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Kallo, Merilent
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Bolotov, Vsevolod A.
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Clarkson, Guy J.
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Schmitt, Wolfgang
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Co-Authors (by relevance)

  • Kallo, Merilent
  • Bolotov, Vsevolod A.
  • Henley, Alice
  • Mccormick, Laura
  • Schröder, Martin
  • Besley, Elena
  • Yang, Sihai
  • Han, Xue
  • Teat, Simon J.
  • Fedin, Vladimir P.
  • Kovalenko, Konstantin A.
  • Zhang, Xinran
  • Dybtsev, Danil N.
  • Samsonenko, Denis G.
  • Smith, Gemma L.
  • Llewellyn, Philip L.
  • Bourelly, Sandrine
  • Amabilino, Silvia
  • Walton, Richard I.
  • Stevens, Thomas W.
  • Millange, Franck
  • Munn, Alexis S.
  • Duren, Tina
  • Clarkson, Guy J.
  • Daniels, Luke M.
  • Düren, Tina
  • Zhu, Nianyong
  • Schmitt, Wolfgang
OrganizationsLocationPeople

article

Metal-organic frameworks from divalent metals and 1,4-benzenedicarboxylate with bidentate pyridine-N-oxide co-ligands

  • Llewellyn, Philip L.
  • Bourelly, Sandrine
  • Amabilino, Silvia
  • Walton, Richard I.
  • Lennox, Matthew J.
  • Stevens, Thomas W.
  • Millange, Franck
  • Munn, Alexis S.
  • Duren, Tina
  • Clarkson, Guy J.
  • Daniels, Luke M.
Abstract

<p>Two Co<sup>2+</sup> metal-organic framework materials, constructed from a combination of 1,4-benzenedicarboxylate (BDC) and either 2,2′-dipyridyl-N-oxide (DPNO) or 2,2′-dipyridyl-N,N′-dioxide (DPNDO), are synthesized under solvothermal reaction conditions, and their structures solved by single crystal X-ray diffraction. Both have three-dimensional structures that contain octahedral Co<sup>2+</sup> centers with μ<sub>2</sub>-(η<sup>2</sup>)-BDC, and bidentate DPNO or DPNDO coligands that bridge pairs of metal centers but do not contribute toward the overall connectivity of the framework. Co<sub>3</sub>(BDC)<sub>3</sub>(DPNO)<sub>2</sub> contains trimers of trans corner-shared Co-centered octahedra with one type of bridging BDC ligand forming terminal edges of the trimers, bridging to neighboring trimer units, and a second type, bridging pairs of metals and also connecting neighboring trimers. Co<sub>2</sub>(BDC)<sub>2</sub>(DPNDO) is constructed from one-dimensional inorganic chains consisting of cis- and trans-corner shared Co<sup>2+</sup>-centered octahedra. The DPNDO ligand is bis-bidentate, forming the edges of one type of octahedron and the trans corners of the second type, with the coordination for both octahedra completed by bridging BDC linkers, which in turn connect the inorganic chains to yield a three-dimensional structure. Thermogravimetric analysis shows both materials contain trapped solvent, and while Co<sub>3</sub>(BDC)<sub>3</sub>(DPNO)<sub>2</sub> is unstable with respect to solvent loss, Co<sub>2</sub>(BDC)<sub>2</sub>(DPNDO), and its magnesium analogue, can be desolvated to yield permanently porous materials that show thermal stability up to 300 °C. For Co<sub>2</sub>(BDC)<sub>2</sub>(DPNDO), gas adsorption studies show permanent microporosity with moderate uptake of small gas molecules (N<sub>2</sub>, CO<sub>2</sub>, CH<sub>4</sub>, and C<sub>2</sub>H<sub>6</sub>), supported by Grand Canonical Monte Carlo calculations based on the assumption of rigid crystal structures, while gravimetric analysis shows rapid and reversible methanol adsorption at ambient pressure for both the Co and Mg analogues of the framework.</p>

Topics
  • porous
  • impedance spectroscopy
  • single crystal X-ray diffraction
  • single crystal
  • Magnesium
  • Magnesium
  • thermogravimetry
  • forming
  • one-dimensional
  • chemical ionisation
  • gravimetric analysis