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Published in 2017 at "Structural Chemistry"
DOI: 10.1007/s11224-017-1009-9
Abstract: In the present work, the cooperativity effect on the NLO response of clusters aggregated with bifurcated metal bonds is reported by DFT calculations at the CAM-B3LYP/6-311++G(d,p) level. Linear clusters of (LiN(CHO)2)1-5 and (NaN(CHO)2)1-5 which are…
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Keywords:
metal bonds;
nlo response;
bifurcated metal;
cluster size ... See more keywords
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2
Published in 2023 at "Inorganic chemistry"
DOI: 10.1021/acs.inorgchem.2c03769
Abstract: Polyoxometalates (POMs) represent a promising class of molecular electron reservoirs. However, their multielectron reduction gives rise to intricate physical-chemical phenomena that must be fully understood for their future use in energy-storage devices. Herein, we show…
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Keywords:
keggin type;
metal bonds;
six electron;
metal ... See more keywords
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Published in 2022 at "Journal of the American Chemical Society"
DOI: 10.1021/jacs.2c01338
Abstract: Assembly of semiconducting organic molecules with multiple aryl-metal covalent bonds into stable one- and two-dimensional (1D and 2D) metal-organic frameworks represents a promising route to the integration of single-molecule electronics in terms of structural robustness…
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Keywords:
aryl metal;
multiple aryl;
metal organic;
metal bonds ... See more keywords