NIST Advanced Technology Program
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First Commercial Heterogeneous Catalyst Developed Using High Throughput Discovery Techniques

Partnering Organizations:
UOP, LLC
Des Plaines, IL 
 and   NovoDynamics, Inc.
Ann Arbor MI
Project Duration and Cost:
  • 1999-2004
  • ATP funding amount:  $14.6M
  • UOP, LLC cost-share amount:  $15.2M  
Project Brief:  99-01-6027
Status Report of the Completed Project: None
Banner with Success Story text.
The Challenge
Without catalysts, a chemical manufacturing process is often either too expensive or simply not possible at all. Catalysts are used in industries as diverse as petroleum, chemicals, pharmaceuticals, and affect virtually every aspect of the business supply chain, from R&D to manufacturing. Typical catalysts are complex substances and may be made from expensive materials. Discovering and developing new catalysts is a slow and inefficient process with long cycle times. The application of combinatorial, or high-throughput experimental methods offers the prospect of finding new catalysts faster and more effectively. However, the use of combinatorial techniques in catalyst discovery is hampered by the complexity (a large number of variables can influence catalytic activity) and poorly developed methods and tools. NIST's Advanced Technology Program (ATP) provided cost-shared funding for a collaborative research project between NovoDynamics Inc, an informatics company, and UOP LLC, a leader and manufacturer of industrial catalytic technology. The goal of the joint venture was to develop novel combinatorial methods and tools to speed the discovery of catalysts, and then demonstrate the use of the approach by its application to catalytic reforming for the production of high-octane, low-sulfur gasoline.
Technical and Economic Impacts
The technical accomplishments of the project were highly successful:
  • UOP and NovoDynamics were able to develop new high-throughput methods to synthesize and test complex catalyst compositions in a miniaturized, massively parallel fashion.
  • The collaboration was able to develop an advanced informatics tool for data management, analysis, mining, and predictive modeling.

The new capability developed by this project led to commercialization of the world’s first catalyst discovered by combinatorial chemistry techniques. Previously unsuccessful efforts had lasted three years and were only able to evaluate 250 compositions. The new paraffin isomerization catalyst PI-242, was identified in just five weeks time by preparing and evaluating over 500 catalyst compositions with the new technique. Then, just 20 months after discovery, PI-242 was commercialized—one of the fastest development times ever for this industry.

The broad-based, national economic impact of this new technology has also been great. For example, the new catalyst allows oil refiners to increase production of low sulfur, high-octane gasoline without additional capital investment in new production capacity. Because this cost can be in the order of millions of dollars, this catalyst represents a significant reduction in production costs.

In addition, the technology has spilled over to other areas. The ATP project helped accelerate UOP’s decision to form a new, wholly-owned subsidiary, Torial Technologies LLC, which offers combinatorial chemistry tools and services for materials discovery. The solutions developed by NovoDymanics, as part of the ATP project, are now incorporated into a new software package, NovoD HTI™, that is used for experimental planning.

Date created:  June 1, 2005
Last updated: August 21, 2006

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