What Are the Challenges in Modeling Nanomaterials?
Modeling nanomaterials presents several challenges:
Complexity: Nanoscale systems often involve complex interactions that are difficult to capture accurately. Computational Cost: High-fidelity simulations, especially quantum mechanical ones, can be computationally expensive. Scale Bridging: Integrating models across different scales (e.g., from atomic to macroscopic) remains a challenging task. Validation: Experimental validation of models is crucial but can be difficult due to the limitations of current experimental techniques.
