Henrique C. S. Junior on Nostr: I'm thrilled to share our new paper in the Journal of Molecular Modeling: "Ab initio ...

I'm thrilled to share our new paper in the Journal of Molecular Modeling: "Ab initio investigation of the geometrical behavior in solution and electronic structure of the anion complexes [bis(1,3-dithiole-2-thione-4,5-dithiolate)M], for M = Bi(III), Sb(III), and Zn(II)." Co-authored with my student Heloisa and my doctoral supervisor Glaucio—three academic generations united! 😄

Read it here: https://doi.org/10.1007/s00894-024-06052-6

#compchem #chemistry #orca # steom