Structural, Molecular and Dynamic Modelling Centre

  • United Kingdom

Organization profile

Profile Information

The activities of this Centre focus on supramolecular and structural chemistry with a specific interest in the formation of transition metal complexes and/or the structural characterisation of these metal containing species. In addition, dynamic modelling of molecules and their interaction with the environment, biological and other molecules is a new development in this centre. The Centres activities include:

  • X-ray diffraction
  • Molecular self assembly
  • Coordination chemistry
  • Solid state chemistry
  • Novel semi-conductor materials
  • Structural characterisation
  • Dynamic modelling in silico


Fingerprint The fingerprint is based on mining the text of the scientific documents related to the associated persons. Based on that an index of weighted terms is created, which defines the key subjects of research unit

Voltage-Dependent Anion Channels Chemical Compounds
Ferrosoferric Oxide Chemical Compounds
Agglomeration Chemical Compounds
Cells Chemical Compounds
Isomers Chemical Compounds
Ligands Chemical Compounds
Iron Chemical Compounds
Dithizone Chemical Compounds

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Research Output 2014 2018

  • 24 Article
  • 1 Conference contribution
  • 1 Review article
Open Access
Parallel flow
Nusselt number
Boundary layers
Petroleum engineering
Negative ions
1 Citation (Scopus)

Mechanism of Carbon Dioxide and Water Incorporation in Ba2TiO4: A Joint Computational and Experimental Study

McSloy, A. J., Trussov, I., Jarvis, A., Cooke, D. J., Slater, P. R. & Panchmatia, P. M., 18 Jan 2018, In : Journal of Physical Chemistry C. 122, 2, p. 1061-1069 9 p.

Research output: Contribution to journalArticle

Open Access
Carbon Dioxide
carbon dioxide
Carbon dioxide

Activities 2014 2014

  • 1 Organising a conference, workshop, ...

International Conference on Green Transport, Renewable Energy and Environment

Lande Liu (Participant)
23 Aug 201424 Aug 2014

Activity: Participating in or organising an event typesOrganising a conference, workshop, ...