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Generative Artificial Intelligence (AI) In Material Science Global Market Report 2025
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Generative artificial intelligence in material science leverages sophisticated algorithms to create new materials by predicting their properties and behaviors through extensive datasets and simulations. This technology speeds up the discovery of new materials, enhances existing ones, and facilitates the development of innovative materials for a range of industrial uses.

The primary types of generative AI in material science include materials discovery and design, predictive modeling and simulation, and process optimization. Materials discovery and design use computational techniques and algorithms to identify and enhance new materials for specific applications. These AI systems can be implemented through cloud-based, on-premises, or hybrid models and are applicable in fields such as pharmaceuticals, chemicals, electronics, semiconductors, energy storage and conversion, automotive, aerospace, construction, infrastructure, and consumer goods.

The generative artificial intelligence in material science market research report is one of a series of new reports from The Business Research Company that provides generative artificial intelligence in material science market statistics, including generative artificial intelligence in material science industry global market size, regional shares, competitors with a generative artificial intelligence in material science market share, detailed generative artificial intelligence in material science market segments, market trends and opportunities, and any further data you may need to thrive in the generative artificial intelligence in material science industry. This generative artificial intelligence in material science market research report delivers a complete perspective of everything you need, with an in-depth analysis of the current and future scenario of the industry.

The generative artificial intelligence (AI) in material science market size has grown exponentially in recent years. It will grow from $1.26 billion in 2024 to $1.68 billion in 2025 at a compound annual growth rate (CAGR) of 33.8%. The growth in the historic period can be attributed to the discovery of new materials, government funding for research and development, rising performance of computing, increasing data availability, and demand for lightweight materials.

The generative artificial intelligence (AI) in material science market size is expected to see exponential growth in the next few years. It will grow to $5.35 billion in 2029 at a compound annual growth rate (CAGR) of 33.6%. The growth in the forecast period can be attributed to the demand for sustainable materials, personalized material design, increased private investment, growth in autonomous systems, and rising adoption of biotechnology applications. Major trends in the forecast period include AI-driven predictive analytics, the development of self-healing materials, the adoption of generative AI in nanomaterial design, decentralized research networks, and the integration of AI with additive manufacturing.

The anticipated growth of generative artificial intelligence (AI) in the material science market is expected to be fueled by increasing investment in AI technologies. This rise in investment is driven by several factors, including heightened demand for automation, improved data analytics, innovative applications, and support from both government and private sectors. Generative AI in material science accelerates discovery and innovation by optimizing material properties and processes, thus attracting significant investment. For example, a May 2022 report by International Business Machines Corporation (IBM) revealed a notable increase in global AI adoption, reaching 35%, up four percentage points from the previous year. The report also projected a 13% increase in the number of firms using AI in 2022 compared to 2021. Specifically, 35% of organizations reported adopting AI, 42% were considering adoption, and 66% were either implementing or planning to use AI to meet their sustainability goals. This growing investment in AI technologies is driving the expansion of generative AI in material science.

Leading companies in the generative AI in material science market are focusing on developing innovative solutions, such as advanced generative AI models for drug discovery, to enhance the speed and efficiency of drug discovery and life sciences research. For instance, in March 2023, Nvidia Corporation, a US-based computer hardware company, introduced the BioNeMo Cloud Service, which includes pre-trained and customizable generative AI models for drug discovery, such as AlphaFold2 and MoFlow. These models accelerate molecular design and optimization, significantly reducing the time and cost associated with research and development, and facilitating the faster identification and creation of new therapeutic candidates and materials.

In January 2024, SandboxAQ, a US-based enterprise SaaS company, acquired Good Chemistry for $75 million. This acquisition aims to enhance SandboxAQ's AI simulation capabilities in drug discovery and materials design by integrating Good Chemistry's quantum and computational chemistry platforms. It will expand SandboxAQ's technology portfolio and accelerate the development of new materials and pharmaceuticals through Good Chemistry's expertise and industry partnerships. Good Chemistry, a Canadian computer application company, utilizes cloud computing technology to predict chemical properties.

Major companies operating in the generative artificial intelligence in material science market are Microsoft Corporation, Siemens AG, International Business Machines Corporation (IBM), NVIDIA Corporation, Hexagon AB, Illumina Inc., ANSYS Inc., DeepMind Technologies Limited, Altair Engineering Inc., OpenAI, Schrodinger Inc., XtalPi, Alchemy Insights Inc., Citrine Informatics Inc., QuesTek Innovations LLC, Materials Zone, Kebotix Inc., Nanotronics Imaging Inc., AION Labs, Exabyte.io

North America was the largest region in the generative artificial intelligence in material science market in 2024. Asia-Pacific is expected to be the fastest-growing region in the forecast period. The regions covered in the generative artificial intelligence in material science market report are Asia-Pacific, Western Europe, Eastern Europe, North America, South America, Middle East, Africa.

The countries covered in the generative artificial intelligence in material science market report are Australia, Brazil, China, France, Germany, India, Indonesia, Japan, Russia, South Korea, UK, USA, Canada, Italy, Spain.

The generative artificial intelligence in material science market includes revenues earned by entities by providing services such as material property analysis consulting, integration services for AI tools in workflows, and technical support and training. The market value includes the value of related goods sold by the service provider or included within the service offering. Only goods and services traded between entities or sold to end consumers are included.

The market value is defined as the revenues that enterprises gain from the sale of goods and/or services within the specified market and geography through sales, grants, or donations in terms of the currency (in USD, unless otherwise specified).

The revenues for a specified geography are consumption values that are revenues generated by organizations in the specified geography within the market, irrespective of where they are produced. It does not include revenues from resales along the supply chain, either further along the supply chain or as part of other products.

Generative Artificial Intelligence (AI) In Material Science Global Market Report 2025 from The Business Research Company provides strategists, marketers and senior management with the critical information they need to assess the market.

This report focuses on generative artificial intelligence (ai) in material science market which is experiencing strong growth. The report gives a guide to the trends which will be shaping the market over the next ten years and beyond.

Reasons to Purchase

Where is the largest and fastest growing market for generative artificial intelligence (ai) in material science ? How does the market relate to the overall economy, demography and other similar markets? What forces will shape the market going forward? The generative artificial intelligence (ai) in material science market global report from the Business Research Company answers all these questions and many more.

The report covers market characteristics, size and growth, segmentation, regional and country breakdowns, competitive landscape, market shares, trends and strategies for this market. It traces the market's historic and forecast market growth by geography.

The forecasts are made after considering the major factors currently impacting the market. These include the Russia-Ukraine war, rising inflation, higher interest rates, and the legacy of the COVID-19 pandemic.

Scope

Table of Contents

1. Executive Summary

2. Generative Artificial Intelligence (AI) In Material Science Market Characteristics

3. Generative Artificial Intelligence (AI) In Material Science Market Trends And Strategies

4. Generative Artificial Intelligence (AI) In Material Science Market - Macro Economic Scenario Macro Economic Scenario Including The Impact Of Interest Rates, Inflation, Geopolitics And Covid And Recovery On The Market

5. Global Generative Artificial Intelligence (AI) In Material Science Growth Analysis And Strategic Analysis Framework

6. Generative Artificial Intelligence (AI) In Material Science Market Segmentation

7. Generative Artificial Intelligence (AI) In Material Science Market Regional And Country Analysis

8. Asia-Pacific Generative Artificial Intelligence (AI) In Material Science Market

9. China Generative Artificial Intelligence (AI) In Material Science Market

10. India Generative Artificial Intelligence (AI) In Material Science Market

11. Japan Generative Artificial Intelligence (AI) In Material Science Market

12. Australia Generative Artificial Intelligence (AI) In Material Science Market

13. Indonesia Generative Artificial Intelligence (AI) In Material Science Market

14. South Korea Generative Artificial Intelligence (AI) In Material Science Market

15. Western Europe Generative Artificial Intelligence (AI) In Material Science Market

16. UK Generative Artificial Intelligence (AI) In Material Science Market

17. Germany Generative Artificial Intelligence (AI) In Material Science Market

18. France Generative Artificial Intelligence (AI) In Material Science Market

19. Italy Generative Artificial Intelligence (AI) In Material Science Market

20. Spain Generative Artificial Intelligence (AI) In Material Science Market

21. Eastern Europe Generative Artificial Intelligence (AI) In Material Science Market

22. Russia Generative Artificial Intelligence (AI) In Material Science Market

23. North America Generative Artificial Intelligence (AI) In Material Science Market

24. USA Generative Artificial Intelligence (AI) In Material Science Market

25. Canada Generative Artificial Intelligence (AI) In Material Science Market

26. South America Generative Artificial Intelligence (AI) In Material Science Market

27. Brazil Generative Artificial Intelligence (AI) In Material Science Market

28. Middle East Generative Artificial Intelligence (AI) In Material Science Market

29. Africa Generative Artificial Intelligence (AI) In Material Science Market

30. Generative Artificial Intelligence (AI) In Material Science Market Competitive Landscape And Company Profiles

31. Generative Artificial Intelligence (AI) In Material Science Market Other Major And Innovative Companies

32. Global Generative Artificial Intelligence (AI) In Material Science Market Competitive Benchmarking And Dashboard

33. Key Mergers And Acquisitions In The Generative Artificial Intelligence (AI) In Material Science Market

34. Recent Developments In The Generative Artificial Intelligence (AI) In Material Science Market

35. Generative Artificial Intelligence (AI) In Material Science Market High Potential Countries, Segments and Strategies

36. Appendix

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