• University of Birmingham Featured PhD Programmes
  • University of Glasgow Featured PhD Programmes
  • University of East Anglia Featured PhD Programmes
  • University of Bristol Featured PhD Programmes
  • London School of Economics and Political Science Featured PhD Programmes
  • Cardiff University Featured PhD Programmes
  • University of Leeds Featured PhD Programmes
  • University of Manchester Featured PhD Programmes
Norwich Research Park Featured PhD Programmes
University of Manchester Featured PhD Programmes
Nottingham Trent University Featured PhD Programmes
University of Surrey Featured PhD Programmes
University of Manchester Featured PhD Programmes

Computational Chemistry to Predict the Colour of Molecules

This project is no longer listed in the FindAPhD
database and may not be available.

Click here to search the FindAPhD database
for PhD studentship opportunities
  • Full or part time
    Dr M Peach
  • Application Deadline
    No more applications being accepted
  • Funded PhD Project (European/UK Students Only)
    Funded PhD Project (European/UK Students Only)

Project Description

A fully funded 3.5 year PhD studentship is available commencing October 2014 to work in the group of Dr Michael Peach, at the Department of Chemistry, Lancaster University, UK. Chemistry at Lancaster took its first intake of students in October 2013, and is an ambitious, rapidly expanding department. As part of this development, we are building a strong research theme in chemical theory and computation. Lancaster University is investing heavily in the infrastructure for the Department; research will be carried out in brand-new, custom-designed computational and practical laboratories.

This project is concerned with the development and application of new theoretical and computational chemistry techniques for the prediction of spectroscopic properties, and in particular, absorption and the colour of emission of molecules. We are particularly interested in molecules for use in organic light-emitting devices (OLEDs).
The project will involve the development of new techniques within time-dependent density functional theory (TDDFT), with an aim to provide a quantitatively correct description of the light interactions of molecules. The project will involve significant theory development, together with applications to technologically-relevant molecules in collaboration with experimental chemists.

The project will involve the development of new techniques within time-dependent density functional theory (TDDFT), with an aim to provide a quantitatively correct description of the light interactions of molecules. The project will involve significant theory development, together with applications to technologically-relevant molecules in collaboration with experimental chemists.
For more information on the research of Dr Michael Peach, see: http://www.peachspapers.com
Maths (familiarity with differential and integral calculus, 2nd order differential equations and group theory) and computer skills (a knowledge of linux and/ or programming) are essential. Training in the relevant quantum chemistry techniques and mathematical background will be provided. As a consequence, the ability to learn and the possession of excellent written and oral communications skills, is also essential, as is a significant interest in theoretical chemistry and spectroscopy. Prior experience with quantum chemistry computer codes is desirable.
Applicants should hold, or expect to receive, a 1st class or good 2:1 Masters-level degree or equivalent in Chemistry or an appropriate related science discipline.
Informal email enquiries prior to making an application are strongly encouraged; contact [email protected]
Applications should be made via Lancaster University’s online application system (see http://www.lancaster.ac.uk/study/postgraduate/how-to-apply-for-postgraduate-study/ for details).

Applications will be considered in the order that they are received and the position may be filled when a suitable candidate has been identified.

When applying please indicate the title of the studentship you are applying for.



Funding Notes

The studentship will cover fees at the UK/EU rate plus the standard maintenance stipend (£ 13,863 for 2014/15).

Related Subjects

How good is research at Lancaster University in Chemistry?

FTE Category A staff submitted: 12.00

Research output data provided by the Research Excellence Framework (REF)

Click here to see the results for all UK universities

Cookie Policy    X