We found the following 20 published projects which all share the keyword calculations in their description.

Title
Battery Materials Analysis
Calculation of structures and molecular physics of gas phase complexes
Computational Chemistry of Main Group Compounds
Computational simulation for fundamental understanding of turbulent reacting flows and its modelling
Computer-aided drug design
Diamond
ELU2024
Excited State Structure of BODIPY Dyes
High Entropy Alloys Design
MEC8095
Membrane Stability
New force fields for simulations of IDPs
Organic Cathode Materials for Li-ion batteries
PHY8045
Phosphorescent Probes for Methylglyoxal
Sustainable Sludge Valorisation Technology for Closed-Loop Resource Recovery
Systematic investigation of pyrolysis process and products for sustainable biochar production
TheoreticalChemistry
dyes
materials modelling halonitrides