Molecular stopwatch measurements of dynamics in catalysts, battery electrolytes and ionic liquids in situ
Molecular stopwatch measurements of dynamics in catalysts, battery electrolytes and ionic liquids in situ
批准号:
MR/S015574/1
负责人:
Paul Donaldson
金额:
$107.17万
依托单位国家:
英国
项目类别:
Fellowship
财政年份:
2019
资助国家:
英国
项目状态:
已结题
起止时间:
2019 至 --
中文摘要
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英文摘要
'Clean growth' and 'Future of mobility' are two challenges in the UK government's industrial strategy. From these challenges are a call for the physical sciences to respond with a better understanding, better predictions and novel ideas in catalysis, battery and fuel cell science at the molecular level. There are many basic, but unanswered questions remaining in these fields. How do molecules react in the pores of Zeolite Catalysts? How does water react at the surface of catalysts to form Hydrogen and Oxygen? What is the mechanism of proton conduction in ionic liquids? Of the many experimental methods available to address these questions, none can easily report on the fastest timescales of molecular motion (femtoseconds), or initiate a reaction fast enough in a heterogeneous catalyst to separate out the earliest steps. This proposal outlines a vision for a UKRI future leaders fellowship to change this by centering on developing and applying new, cutting edge ultrafast IR methods in-situ to answer these key molecular dynamical questions in catalysis, ionic liquids and fuel cell electrolytes. The experiments proposed will reach out to reveal the fastest timescales of the motions and chemical transformations of the key molecules involved - information currently inaccessible to researchers in the field. This information will i) reveal new aspects of the behaviour of these complex molecular systems, ii) provide information that can guide and verify molecular dynamics simulations (one of the best predictive tools available to chemical scientists) and iii) be used as a powerful means of empirically comparing the behavior of different catalysts or electrolytes.
期刊论文(7)
专著(0)
科研奖励(0)
会议论文
Laser induced temperature-jump time resolved IR spectroscopy of zeolites
沸石的激光诱导温跃时间分辨红外光谱
DOI:
10.26434/chemrxiv-2023-p5gsr
发表时间:
2023
期刊:
影响因子:
--
作者:
[Hawkins A]
通讯作者:
Hawkins A
DOI:
10.1063/5.0044822
发表时间:
2021-04-07
期刊:
JOURNAL OF CHEMICAL PHYSICS
影响因子:
4.4
作者:
[Johnson, Clinton A., Parker, Anthony W., Garrett-Roe, Sean]
通讯作者:
Garrett-Roe, Sean
Ultrafast 2D-IR spectroscopy of intensely optically scattering pelleted solid catalysts.
强光学散射颗粒固体催化剂的超快二维红外光谱。
DOI:
10.1063/5.0139103
发表时间:
2023
期刊:
The Journal of chemical physics
影响因子:
--
作者:
[Donaldson PM]
通讯作者:
Donaldson PM
海外基金