RA in Battery Materials Modelling

Newcastle University is a great place to work, with excellent benefits. We have a generous holiday package; plus the opportunity to buy more, great pension schemes and a number of health and wellbeing initiatives to support you. Closing Date: 01 December 2025 The Role We are looking to appoint a Research Associate in the modelling of battery materials in the Ion Transport and Interfaces Group of Dr. James A. Dawson at Newcastle University. The position is initially for 2 years with the possibility of extension subject to future funding. Depending on the successful candidate’s interests and expertise, this position will be focused on either (or a combination of) the atomistic modelling of liquid and solid electrolytes, cathode materials or electrolyte-electrode interfaces. The candidate will be expected to use a combination of density functional theory, ab initio and classical molecular dynamics, machine learning approaches, including machine learning forcefields, and other complementary methods. The project is part of a UKRI Frontier Research Grant (“AMPed”) and will be carried out in collaboration with world-leading experimental partners in the UK, including the Faraday Institution, Europe and North America. Our ambition is to develop and apply state-of-the-art computational techniques to provide a fundamental understanding of structure, dynamics and interfaces in battery materials for next-generation energy storage devices. Applications should be made through the Newcastle University jobs portal: https://jobs.ncl.ac.uk, where you are invited to provide evidence of how you meet the essential criteria required for the role outlined in ‘The Person’ by uploading a letter of application along with your Curriculum Vitae (CV). Key Accountabilities To design, carry out and analyse computational simulations To liaise with the principal investigator and other team members to plan, organise and carry out the work programme To disseminate research results through appropriate media. This will include authoring or co-authoring papers for publication in high-quality academic journals To contribute to existing and new interdisciplinary collaborations To train and assist undergraduate and postgraduate students in theoretical techniques and computational methods Represent the research group and disseminate information about its work at national and international events Contribute to learning and development through the provision of documentation, training and advice Undertake relevant training and development activities in order to develop an awareness of own professional development needs Maintain and develop knowledge to keep abreast of the latest and most relevant technologies Any other duties within the scope and general nature of the grade which may be required The Person (Essential) Knowledge, Skills and Experience Experience in the simulation of solid-state and/or energy materials Experience in molecular dynamics and electronic structure simulations Experience in Python programming Excellent written and oral communication skills High level of problem-solving capacity Attributes and Behaviour Comfortable working both individually and have good team working skills Capacity for original thought Enthusiasm and a strong work ethic Ability to interact with researchers with different backgrounds Ability to communicate scientific results to a broad or non-specialist audience Ability and willingness to work in interdisciplinary environments Well-developed interpersonal communication skills that enable you to engage external and internal stakeholders and work effectively in a multidisciplinary team Qualifications An undergraduate degree (or equivalent) in a relevant science subject, such as chemistry, physics or materials science A Ph.D. in the field of computational chemistry or materials science or a related discipline Newcastle University is a global University where everyone is treated with dignity and respect. As a University of Sanctuary, we aim to provide a welcoming place of safety for all, offering opportunities to people fleeing violence and persecution. We are committed to being a fully inclusive university which actively recruits, supports and retains colleagues from all sectors of society. We value diversity as well as celebrate, support and thrive on the contributions of all of our employees and the communities they represent. We are proud to be an equal opportunities employer and encourage applications from individuals who can complement our existing teams, we believe that success is built on having teams whose backgrounds and experiences reflect the diversity of our university and student population. At Newcastle University we hold a GoldAthena Swan award in recognition of our good employment practices for the advancement of gender equality. We also hold a Race Equality Charter Bronze award in recognition of our work towards tackling race inequality in higher education REC. We are a Disability Confident employer and will offer an interview to disabled applicants who meet the essential criteria for the role as part of the offer and interview scheme. In addition, we are a member of the Euraxess initiative supporting researchers in Europe. #J-18808-Ljbffr