@jgrebol10.bsky.social
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Molt content d'haver ensenyat part de la meva recerca a la 2a Reunió de Química Teòrica i Computacional. Molt més content, però, d'haver-ho pogut fer en català!! 😜
@scq.iec.cat
12 months ago
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Starting in BlueSky by showing the paper we published in
#CEJ
to evaluate the aromaticity in large conjugated circuits from the electronic point of view. Computationally really cheap and exact, so that's cool! 😛
tinyurl.com/55793mn9
#ChemSky
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Can Aromaticity Be Evaluated Using Atomic Partitions Based on the Hilbert‐Space?
This article introduces Hilbert-space partitions – meta-Löwdin, NAO, and IAO – as reliable and economical alternatives to real-space partitions commonly used to measure aromaticity. These new partiti....
https://tinyurl.com/55793mn9
about 1 year ago
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