The First Chemically Accurate Tools in Theoretical Materials Research

非金属材料广泛应用于催化、分离和传感等领域。这个项目将为非金属材料的计算研究创造一种新的、准确的、通用的和系统的方法，并将为我们设计这些材料用于特定应用的能力提供巨大的进步。随着需求的不断增长，世界人口的不断增长和自然资源的不断减少，这种合理的材料设计的好处影响了化学，工程，电子和生物应用中新的，更安全，更高效，可重复使用的材料的发展。

Non-metallic materials are widely used in catalytic, separation and sensing applications. This project will create a new, accurate, general and systematic approach to the computational study of non-metallic materials and will provide an enormous step forward in our ability to design these materials for specific applications. With ever increasing demand, growing world population and shrinking natural resources, the benefits of such rational materials design impact on the development of new, safer, more efficient, reusable materials in chemical, engineering, electronic and biological applications.