Generative AI in Material Science Market Revenue to Attain USD 12.90 Bn by 2035
Generative AI in Material Science Market Revenue and Trends 2026 to 2035
The global generative AI in material science market revenue was valued at USD 1.49 billion in 2025 and is expected to attain around USD 12.90 billion by 2035, growing at a CAGR of 24.10% during forecast period.This market is experiencing unprecedented growth, driven by the growing demand for advanced and sustainable materials across various industries such as automotive, aerospace, and energy.

What are the Factors Contributing to the Growth of the Market?
The increasing need to accelerate R&D, reduce costs, and discover high-performance materials is the major factor driving the growth of the generative AI in material science market. Generative AI significantly reduces the time and cost associated with experimental & trial-and-error methods. Generative AI is also most widely used to accelerate the discovery of biodegradable plastics, rare-earth-free magnets, and battery chemistries through data-driven simulation and design. Generative AI increases efficiency and reduces the cost of producing new materials. The market’s growth is also primarily supported by rapid technological innovation, such as AI-driven predictive modelling and cloud-based simulations. The rising integration of AI with digital twins and robotic laboratories allows for closed-loop material discovery.
Segment Insights
- By type, the materials discovery and design segment held the largest market share of approximately 42% in 2025, owing to the rising need for AI-accelerated materials discovery. Several leading companies in materials discovery are increasingly prioritizing AI-driven materials discovery.
- By deployment, the cloud-based segment held the largest market share of approximately 47% in 2025. Cloud-based solutions are increasingly used to design high-capacity battery electrolytes, carbon capture sorbents, and rare-earth-free magnets. The adoption of cloud-based infrastructure enables the integration of generative AI with self-driving laboratories.
- By application, the pharmaceuticals and chemicals segment registered its dominance in the market while holding a share of approximately 26% in 2025. The segment dominance is supported by the increasing role of generative AI in material discovery, pharmaceutical formulation, molecular design, and various clinical applications.
Regional Insights
North America dominates the global generative AI in material science market. The region is home to the world's leading technology companies, such as Microsoft Corporation, IBM Corporation, NVIDIA, Google LLC, NVIDIA Corporation, OpenAI, Siemens Corporation, and others. The region leadership position is attributed to the rise of digital twins & automation, rapid shift towards cloud-based platforms, growing focus on sustainability, and rising demand for clean energy. Moreover, the rising demand for novel materials with specific and tailored properties in various sectors like aerospace, energy storage, and others is driving the adoption.
On the other hand, Asia Pacific is a rapidly growing region in the generative AI in material science market. The growth of the region is attributed to the expanding digital infrastructure, rising demand in manufacturing, sustainability mandates, rapid cloud adoption, rising government support for AI R&D, and growing demand across various industries.
Generative AI in Material Science Market Coverage
| Report Attribute | Key Statistics |
| Market Revenue in 2025 | USD 1.49 Billion |
| Market Revenue by 2035 | USD 12.90 Billion |
| CAGR from 2026 to 2035 | 24.10% |
| Quantitative Units | Revenue in USD million/billion, Volume in units |
| Largest Market | North America |
| Base Year | 2025 |
| Regions Covered | North America, Europe, Asia-Pacific, Latin America, and the Middle East & Africa |
Recent Development
- In November 2025, Hyundai Motor Group announced a strategic partnership with CuspAI, a frontier AI startup pioneering the discovery of breakthrough materials, to accelerate the development of innovative materials through artificial intelligence (AI) technology. Hyundai Motor Group and CuspAI have signed a partnership agreement in Cambridge, United Kingdom, to establish a framework for their collaboration across multiple domains.(Source: https://www.hyundainews.com)
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