Projects per year
Personal profile
Academic / Professional qualifications
Member of the Institute of Physics
Fellow of the Higher Education Academy
Personal Statement
My research focuses on (but is not limited to) soft-hard matter interfaces, including polymer composites and heterogeneous nucleation. I use multiscale simulations to provide insight into material properties and I enjoy collaborating closely with experimentalists. I am driven by curiosity and I am interested in a variety of systems, such as phase behaviour of soy milk coffee mixtures. For more information please visit my personal webpage:
http://personal.strath.ac.uk/karen.johnston/
Teaching Interests
My teaching philosophy is to provide the best learning environment by challenging students through providing questions related to everyday exampes, that develop student's understanding and problem solving skills.
I am the course organiser and lecturer for CP102 Introduction to Chemical Engineering: Fundamentals, Techniques and Tools, and I supervise CP407 design projects, 18350 MEng projects, and Distance Learning MSc projects.
Research Interests
Polymer composites are widely used in industry due to their strength, flexibility and light weight. Although generic properties of polymers at surfaces are well understood the interaction between a particular polymer and filler particle is not. The main challenge in simulating polymer-solid interfaces is the different length and time scales involved. This research bridges the gap between the micro- and mesoscale properties using a hierarchical multiscale approach. Density functional theory (DFT) calculations are used to obtain the detailed quantum interactions at the interface and this information is used to build surface potentials for atomistic and coarse-grained (CG) molecular dynamics simulations.
Expertise & Capabilities
- Density functional theory (DFT): electronic structure, adsorption and surface energies, vibrational frequencies etc.
- Molecular dynamics (MD) simulations: structure and dynamics of thin films, liquids, solutions, solids etc.
Expertise related to UN Sustainable Development Goals
In 2015, UN member states agreed to 17 global Sustainable Development Goals (SDGs) to end poverty, protect the planet and ensure prosperity for all. This person’s work contributes towards the following SDG(s):
Education/Academic qualification
Doctor of Philosophy, Queen's University Belfast
Award Date: 1 Jan 2003
Master in Science, Queen's University Belfast
Award Date: 1 Jan 1999
Keywords
- Density functional theory; molecular dynamics
- Polymers
- Classical molecular dynamics simulations
- Multiscale modelling
- Interfaces
- Surfaces
- Adsorption
- Ferroelectrics
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Network
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IBioIC CTP PhD studentship Optimisation of alginate films for sustainable food packaging applications
BBSRC (Biotech & Biological Sciences Research Council)
1/10/21 → 30/09/25
Project: Research - Studentship
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ISCF - Biocomposite design for food packaging
Johnston, K., Liggat, J., Mulheran, P. & Magueijo, V.
NERC (Natural Environment Research Council)
1/11/20 → 30/04/24
Project: Research
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Chitin and chitosan binding to the α-chitin crystal; a molecular dynamics study
Hudek, M., Kubiak-Ossowska, K., Johnston, K., Ferro, V. A. & Mulheran, P. A., 10 Jan 2023, (E-pub ahead of print) In: ACS Omega. 8 p.Research output: Contribution to journal › Article › peer-review
Open AccessFile2 Downloads (Pure) -
Polyhydroxybutyrate: a review of experimental and simulation studies of the effect of fillers on crystallinity and mechanical properties
Majerczak, K., Wadkin-Snaith, D., Magueijo, V., Mulheran, P., Liggat, J. & Johnston, K., 31 Dec 2022, In: Polymer International. 71, 12, p. 1398-1408 11 p.Research output: Contribution to journal › Review article › peer-review
Open AccessFile5 Citations (Scopus)15 Downloads (Pure)
Datasets
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Data for: "Polyhydroxybutyrate: a review of experimental and simulation studies on the effect of fillers on crystallinity and mechanical properties"
Majerczak, K. (Creator), Wadkin-Snaith, D. (Creator), Magueijo, V. (Creator), Mulheran, P. (Creator), Liggat, J. (Creator) & Johnston, K. (Creator), University of Strathclyde, 6 Apr 2022
DOI: 10.15129/36891b98-7209-409b-b7f9-8f68ac119ed8
Dataset
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Data for: "Tuning Interfacial Concentration Enhancement through Dispersion Interactions to Facilitate Heterogeneous Nucleation"
McKechnie, D. (Creator), Mulheran, P. (Supervisor), Sefcik, J. (Supervisor) & Johnston, K. (Supervisor), University of Strathclyde, 2 Sept 2022
DOI: 10.15129/8d54c68e-69a6-4215-8a4c-d0141d3f2baf
Dataset
Prizes
Activities
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High Polymer Research Group
Karen Johnston (Participant)
23 Apr 2023 → 27 Apr 2023Activity: Participating in or organising an event types › Participation in conference
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SSPP Summit
Karen Johnston (Participant)
28 Mar 2023Activity: Participating in or organising an event types › Participation in conference