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Journal Article
Journal of the American Chemical Society, ISSN 0002-7863, 04/2013, Volume 135, Issue 15, pp. 5877 - 5884
Journal Article
Computational and Theoretical Chemistry, ISSN 2210-271X, 05/2016, Volume 1084, pp. 162 - 168
[Display omitted] •Different basis sets and functionals were compared.•A zirconium oxo cluster was used as a model system.•Bond distances are best reproduced... 
Carboxylate ligands | Clusters | Zirconium
Journal Article
Journal of the American Chemical Society, ISSN 0002-7863, 01/2013, Volume 135, Issue 1, pp. 494 - 500
Carbon has been used widely as the basis of porous cathodes for nonaqueous Li–O2 cells. However, the stability of carbon and the effect of carbon on... 
Journal Article
Environmental toxicology and chemistry, ISSN 0730-7268, 2014, Volume 33, Issue 2, pp. 243 - 267
Journal Article
Chemistry, an Asian journal, ISSN 1861-4728, 2013, Volume 8, Issue 5, pp. 982 - 989
Journal Article
Sensors & Actuators: B. Chemical, ISSN 0925-4005, 01/2014, Volume 190, pp. 999 - 1005
Journal Article
Angewandte Chemie (International ed.), ISSN 1433-7851, 2013, Volume 52, Issue 19, pp. 5056 - 5060
It's all in the mix! Metal–organic frameworks (MOFs) were constructed from iron(III) trimers and mixtures of di‐ and tricarboxylate linkers. The dicarboxylate... 
iron | metal–organic frameworks | carboxylate ligands | microporous materials | mesoporous materials | metal-organic frameworks | TOPOLOGY | SURFACE-AREA | BEHAVIOR | SORPTION | MOFS | ADSORPTION | CHEMISTRY, MULTIDISCIPLINARY | metalorganic frameworks | CLUSTERS | SITES | DIFFRACTION | COORDINATION COPOLYMER | Iron | Pictures | Construction | Trimers | Porosity | Metal-organic frameworks | Carboxylates | Physics | Chemical Physics
Journal Article
Surface Science, ISSN 0039-6028, 02/2019, Volume 680, pp. 18 - 23
The adsorption of CO molecules at the Ca Ru O (001) surface was studied using low-temperature scanning tunneling microscopy (STM) and density functional theory... 
Carboxylate | Calcium ruthenate | DFT | Carbon monoxide | STM
Journal Article
Nature communications, ISSN 2041-1723, 2019, Volume 10, Issue 1, pp. 845 - 20
Journal Article
Angewandte Chemie (International ed.), ISSN 1433-7851, 2013, Volume 52, Issue 22, pp. 5880 - 5884
Journal Article