Computational design of frontier materials for sustainable technologies

可持续技术前沿材料的计算设计

• 批准号: FL230100176
• 负责人: Prof Catherine Stampfl
• 金额: $ 199.75万
• 依托单位: The University of Sydney
• 依托单位国家: 澳大利亚
• 项目类别: Australian Laureate Fellowships
• 财政年份: 2024
• 资助国家: 澳大利亚
• 起止时间: 2024-01-01 至 2028-12-31
• 项目状态: 未结题
• 来源: https://dataportal.arc.gov.au/RGS/Web/Grants/FL230100176
• 关键词: Computational; design; frontier; materials; sustainable

This Laureate will establish a new and powerful computational materials research platform that uses cutting-edge ab initio calculations and artificial intelligence, to understand and design tailored structures that possess the required new and improved functionalities for tomorrow’s materials. In enabling the development of novel catalysts needed for the generation of green fuels and chemicals, and key quantum devices for quantum technologies, this Laureate promises timely support for Australia’s commitment to renewable energies, low emissions and its nascent quantum future. New and existing collaboration with leading international groups underpin significant national benefits including new disciplinary capacity and world-class research.

该获奖者将建立一个新的功能强大的计算材料研究平台，该平台使用尖端的从头算计算和人工智能，以了解和设计量身定制的结构，以实现明天材料所需的新功能和改进的功能。在实现生成绿色燃料和化学物质所需的新型催化剂以及量子技术的关键量子设备时，这种获奖者有望及时支持澳大利亚对可续签能量，低排放及其新生量子的承诺的承诺。与领先的国际团体的新合作和现有的合作基础是全国福利，包括新的纪律能力和世界一流的研究。