利兹大学PhD Position in Computer Aided Design for Green Ammonia Catalysis申请条件要求-申请方
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利兹大学
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About the Project
This project is located at the intersection between two of the most consequential trends in modern society, namely, the rise in computer aided discovery and the necessity in moving towards a sustainable and circular economy. Currently, ammonia (NH3) synthesis uses between 3 and 5% of the world’s production of natural gas with approximately 50% of the world’s food production coming from ammonia synthesis. Unfortunately, the current industry standard is the century-old Haber-Bosch process, which is very inefficient and consumes approximately 1.8% of global energy output. It has been known for a century that finding the correct catalyst for the nitrogen reduction reaction would have a transformative effect on energy and food security as well as representing one of the holy grails of modern sustainable chemistry. The problem is that in many cases the desired nitrogen reduction reaction (NRR) is outcompeted on the surface of the catalyst by the unfavourable hydrogen evolution reaction (HER). Transition metal nitrides offer a tempting target for rational catalysis design because they contain inherent nitrogen atoms that can favour NRR over HER. Whilst, nitrides offer tempting target the immense chemical space of this class of materials means that classical synthetic chemical solutions would be insufficient on their own to explore the diverse catalysis of these material.
This project will involve:
(i) A first principles DFT study into the bulk and surface electronic properties of multiple transition metal carbides.
(ii) Use of these calculations to create Machine Learning Potentials for an Artificial Intelligence driven molecular dynamics exploration of transition metal nitride chemical space (see link).
(iii) Full characterisation of the ammonia synthesis reaction by selected transition metal nitrides.
The student will benefit from the Quesne’s groups affiliation to the Materials Modelling Consortium (MMC), various Chemistry Computational Projects (CCPs) and STFC Scientific Computing (STFC-SCD), which provides a large network of colleagues to share knowledge and best practice of the latest software developments. They will also collaborate with some of the leading catalysis related Hubs of UK excellence, namely, the UK Catalysis Hub and the Cardiff Catalysis Hub.
https://phd.leeds.ac.uk/project/2157-computer-aided-design-for-green-ammonia-catalysis
利兹大学 PhD Position in Computer Aided Design for Green Ammonia Catalysis项目有没有奖学金，是不是全奖Phd招生，下面我们一起看一下【大学名称】Phd的奖学金资助情况
项目资助情况
A highly competitive EPSRC Doctoral Landscape Award providing full academic fees, together with a tax-free maintenance grant at the standard UKRI rate (£19,237 in academic session 2024/25) for 3.5 years. Training and support will also be provided.
利兹大学Phd申请条件和要求都有哪些？PhD Position in Computer Aided Design for Green Ammonia Catalysis项目是不是全奖？有没有奖学金？下面我们一起看一下利兹大学申请Phd直招需要具备哪些条件和要求，以及托福、雅思语言成绩要到多少才能申请。
申请要求
Entry requirements
Applicants to research degree programmes should normally have at least a first class or an upper second class British Bachelors Honours degree (or equivalent) in an appropriate discipline. The criteria for entry for some research degrees may be higher, for example, several faculties, also require a Masters degree. Applicants are advised to check with the relevant School prior to making an application. Applicants who are uncertain about the requirements for a particular research degree are advised to contact the School or Graduate School prior to making an application.
English language requirements
The minimum English language entry requirement for research postgraduate research study is an IELTS of 6.0 overall with at least 5.5 in each component (reading, writing, listening and speaking) or equivalent. The test must be dated within two years of the start date of the course in order to be valid. Some schools and faculties have a higher requirement.
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