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Chemistry and Mathematics in Phase Space (CHAMPS)

相空间中的化学和数学（CHAMPS）

基本信息

批准号：
EP/P021123/1
负责人：
Steve Wiggins
金额：
$ 525.52万
依托单位：
University of Bristol
依托单位国家：
英国
项目类别：
Research Grant
财政年份：
2017
资助国家：
英国
起止时间：
2017 至无数据
项目状态：
已结题

来源：
https://gtr.ukri.org/projects?ref=EP%2FP021123%2F1
关键词：
Chemistry Mathematics Phase Space CHAMPS

项目摘要

The 6 year CHAMPS Programme Grant (PG) addresses the urgent need to provide a framework for understanding and exploiting the explosion in dynamical information coming out of modern experiments and simulations in chemistry and chemical biology. By developing methods in nonlinear dynamics to replace the ubiquitous configuration-space projections of these inherently multidimensional datasets with phase-space representations, it will be possible to provide comprehensible models that capture the key dynamics of complex systems. These new models will revolutionise our understanding of chemical transformation, with impacts on all industries that rely on understanding chemical change, from the pharmaceutical industries to those in the rapidly developing energy sector. By its very nature, the research will have impact on a wide variety of EPSRC research themes, including health care, energy, and environmental change. And because the work requires an unprecedented partnership between mathematicians and chemists, it will bridge several themes that EPSRC has highlighted as critical to its strategy. The young scientists trained in this programme will have unmatched interdisciplinary skills, and provide UK research leadership for decades to come. In particular, we expect that they will be creating their own new fields of study, and will thereby carry on attracting the best young scientists from around the world to come to the UK. A PG is vital to provide the critical mass, flexibility and scope needed to tackle the major scientific cross-disciplinary challenges set out in this proposal. The alternative funding model of individual grants to the PI and CoIs would leave the PDRAs localised in particular research groups and thereby maintain the traditional disciplinary separation, which we are seeking to break down.

6年CHAMPS计划补助金（PG）解决了迫切需要提供一个框架，以了解和利用来自化学和化学生物学现代实验和模拟的动态信息爆炸。通过开发非线性动力学方法，用相空间表示取代这些固有多维数据集的无处不在的配置空间投影，将有可能提供可理解的模型，捕捉复杂系统的关键动力学。这些新模型将彻底改变我们对化学变化的理解，对依赖于理解化学变化的所有行业产生影响，从制药行业到快速发展的能源行业。就其本质而言，该研究将对EPSRC的各种研究主题产生影响，包括医疗保健，能源和环境变化。由于这项工作需要数学家和化学家之间建立前所未有的伙伴关系，它将弥合EPSRC强调的对其战略至关重要的几个主题。在该计划中培训的年轻科学家将拥有无与伦比的跨学科技能，并在未来几十年内为英国提供研究领导。特别是，我们希望他们将创造自己的新研究领域，从而继续吸引世界各地最优秀的年轻科学家来到英国。方案小组对于提供必要的临界质量、灵活性和范围，以应对本提案中提出的重大科学跨学科挑战至关重要。另一种资助模式，即个别赠款予研究所和研究委员会，会令专业发展评核计划局限于特定的研究小组，从而维持传统的学科分隔，而我们正寻求打破这种分隔。