Mechanical

Explore the limits of strength and durability of materials for cutting-edge technological applications

Electronic

Analyze conductivity, band gaps, charge mobility and other electronic properties of semiconductors, conductors and insulators

Thermal

Evaluate thermal conductivity, heat capacity, expansion coefficients for high-performance thermal management, energy efficiency and thermal stability

Optical

Analyze refractive indices, absorption spectra, susceptibilities of transparent, reflective, or light-emitting materials

Surface Chemistry

Explore surface interactions, surface affinities, and chemical reactivity of large datasets of molecules

Spectroscopy

Analyze the spectral fingerprint of materials and molecules, utilizing advanced spectroscopic computational methods for materials identification, compositional insights and characterization

Reactivity

Navigate the complex landscape of materials reactivity, assessing reaction rates, catalytic behaviours, and stability of functionalized materials