@jgrebol10.bsky.social
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
January 27, 2025 at 4:42 PM
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
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
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....
tinyurl.com
December 11, 2024 at 8:53 AM
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