Scientific computing
Pyknotita
Density functional theory methods for studying electronic structure and materials.
What you can explore
Explore electronic-structure calculations using density functional theory.
Scope and availability
Pyknotita is the partner’s DFT research offering. Applicable systems, approximations and computational resources are confirmed during evaluation.
A useful first evaluation
Define the material or molecule, approximation and convergence criteria. Compare energies and properties against a trusted DFT workflow.
Start with your problem.
Talk to Quzones about Pyknotita, your constraints and the next practical step.
Discuss an evaluation ↗