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Materials Science

Designing new materials and optimizing existing ones is often a long and iterative process. Even small changes to the chemistry can result in large changes to the bulk scale properties, and bridging this gap can be difficult without a fundamental understanding of what is happening at the molecular level.

Accelerating Materials Science

Rowan helps you develop new materials faster by providing insight into your chemistry and screening new materials quickly. Our modern, easy-to-use software provides you with tools to quickly understand reactivity, stability, turnover frequency, emmissivity, and many other properties. Screen large numbers of compounds to determine which one are most promising to bring into the lab. Model the physics of a catalytic reaction to gain insight into its mechanism or the selectivity for one product over another. Predict the interaction between molecules to gain insight into bulk properties or crystallization.

Using Rowan saves you time by putting state-of-the art tools into the hands of traditional chemists, eliminating the need to have dedicated experts. You can run computations in the cloud to eliminate the capital costs of on-premises compute or run it locally on your existing infrastructure if you already have the resources. An intuitive graphical user interface with publication quality graphics allows anyone to use the platform to answer their chemical questions. Automatic scaling of compute resources and simple billing allow you to save on compute by giving you access to virtually unlimited compute power, providing you answers when you need them—not just when your compute resources are finally available.

A Differentiated Simulation Platform

We take care of the software so you can focus on the science.

Rowan is dramatically different from legacy simulation software packages. Our platform is built around cutting-edge ML-accelerated simulations, enabling us to generate results faster and with higher predictive power. Using Rowan ensures that the latest advances in chemical modeling, machine learning, and high-performance computing will always be available to your team.

Rowan's software is easy-to-use and runs from your web browser, making it simple for scientists with any background to benefit from our simulations and workflows. We automatically allocate high-performance computing resources, stream updates as calculations are running, and generate publication-quality visuals for every calculation.

Don't know how to get started with computations? Rowan comes with built-in workflows designed to provide high-accuracy predictions across a variety of workflows. Our team of expert computational chemists and computer scientists works hard to make sure that our platform answers your scientific questions quickly and accurately, so you can benefit from Rowan without ever having run computations before.

Enabling Innovation

Advances in physics based modeling and ML are opening up new possibilities for materials science. Novel techniques are quickly being adopted by the most innovative companies, allowing them to develop high-performance materials, novel electrolytes, enantioselective catalysts, high purity specialty-chemicals, and next generation OLED dopants at unprecedented speeds. If you want to bring the power of physics-based modeling and ML tools to your organization, Rowan is the perfect choice for you.

Further Reading

Catalysis

Screening catalysts and predicting reaction mechanisms
Jul 13, 2024 · Jonathon Vandezande
Catalysis

Organic Light Emitting Diodes (OLEDs)

Optimizing the efficiency, stability, and color of next-generation OLEDs while reducing environmental impact
Jul 13, 2024 · Jonathon Vandezande
Organic Light Emitting Diodes (OLEDs)
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