
Student Projects
If you are interested in a project, contact the respective PI
Design Principles
Secondary electrostatic interaction model
Predicting hydrogen bond strength

Chalcogen size & H-bond strength
The bigger the better!

Software Development
TCPlot
Automating plotting software

TCUtility
Developt methods to help chemists

Single Atom Catalysis
Hydrogen evolution reaction
Towards green hydrogen

From homogeneous to heterogeneous catalysis
Pushing the limit!

Automation
Workflow Development
Automate the tedious stuff!
Chemical Discovery
Where innovation meets exploration
Contact


Chemical Bond Strength
Understanding bond theory
Atom size versus electronegativity difference


DNA & Metals
G-quadruplexes
Getting intimate with pollution metals
Metallophilicity
Orbital attraction and repulsion


Lewis Acid Catalysis
Contact
Rational Design of Ene Reactions
Increasing asynchronicity, decreasing Pauli repulsion


Hydrogen-Bonded Polymers
Linear chains of squaramides
Longer is stronger!

Benzene-1,3,5-triamide polymers
A matter of size

Pd/Fe Catalysis
Understanding trends on oxidative addition
Fe: C–H < C–Cl < C–C | Pd: C–Cl < C–H < C–C


Artificial Intelligence
Contact
Design New Catalysts
The catalyst for intelligent solutions

Training Models
Understand and predict

Computational Methods
PyFrag
Uncover the physical cause

PyOrbb
Automated orbital analyses
