Lucas de Azevedo Santos

21PUBLICATIONS
25CO-AUTHORS
Computational chemistryTheoretical quantum chemistryOther built environment and design not elsewhere classifiedArt theoryChemical thermodynamics and energetics
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Publications (21)

|Nov 08, 2025
Hydrogen Bond Benchmark: Focal-Point Analysis and Assessment of DFT Functionals.

Erica C Mitchell, Lucas Azevedo Santos, Pascal Vermeeren

|Jun 03, 2025
The spectrum from van der Waals to donor-acceptor bonding.

Daniela Rodrigues Silva, Lucas de Azevedo Santos, Matthijs A J G Koning

|Sep 03, 2024
"Hydridic Hydrogen-Bond Donors" Are Not Hydrogen-Bond Donors.

Lucas de Azevedo Santos, Pascal Vermeeren, F Matthias Bickelhaupt

|Jul 24, 2024
The nature of metallophilic interactions in closed-shell d8-d8 metal complexes.

Lucas de Azevedo Santos, Timon Wagner, Klaas Visscher

|Jan 03, 2024
Blueshift in Trifurcated Hydrogen Bonds: A Tradeoff between Tetrel Bonding and Steric Repulsion.

Lucas de Azevedo Santos, Storm van der Voort, Shiri R Burema

|Dec 06, 2023
Multiple hydrogen-bonded dimers: are only the frontier atoms relevant?

Celine Nieuwland, David Almacellas, Mac M Veldhuizen

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