Demeter Tzeli

54PUBLICATIONS
70CO-AUTHORS
Cheminformatics and quantitative structure-activity relationshipsTheoretical quantum chemistryWater treatment processesTheory and design of materialsStructure and dynamics of materials
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Publications (54)

|Jul 28, 2026
In Silico Docking and Spectroscopic Evaluation of a Thiocarbohydrazone Derivative: Structural Elucidation and Enzyme Inhibitory Mechanisms.

|Jul 23, 2026
Cooperative stability, many-body expansion, and σ-aromaticity of (LiH)n clusters (n = 1-6): A CCSD(T) study at the complete basis set limit.

|May 14, 2026
Photophysical tuning via piperazine nitrogen torsion in a ferrocene-aminonaphthalimide derivative.

|Jan 26, 2026
Similarities and Differences on the Electronic Structure and Chemical Bonding of Isoelectronic Molecules: X2NH and HNX2NH, where X = N and C.

Georgios A Tsekouras, Demeter Tzeli

|Oct 27, 2025
Electronic structure and chemical bonding of the MoBe molecule.

Constantinos Demetriou, Demeter Tzeli

|Sep 29, 2025
Conformational and Functional Properties of the Bioactive Thiosemicarbazone and Thiocarbohydrazone Compounds.

Nikitas Georgiou, Ektoras Vasileios Apostolou, Stamatia Vassiliou

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Frequent Collaborators

10 joint publications

Thomas Mavromoustakos

8 joint publications

Sotiris S Xantheas

8 joint publications

Nikitas Georgiou

4 joint publications

Christina Eleftheria Tzeliou