Edinburgh Research Explorer

Graeme Ackland

Chair in Computer Simulation

  1. 1997
  2. Computer simulation of point defect properties in dilute Fe-Cu alloy using a many-body interatomic potential

    Ackland, G. J., Bacon, D. J., Calder, A. F. & Harry, T., Mar 1997, In: Philosophical Magazine A: Physics of Condensed Matter, Structure, Defects and Mechanical Properties. 75, 3, p. 713-732 20 p.

    Research output: Contribution to journalArticlepeer-review

  3. Properties of liquid crystal molecules from first principles computer simulation

    Clark, SJ., Adam, CJ., Ackland, GJ., White, J. & Crain, J., Apr 1997, In: Liquid crystals. 22, 4, p. 469-475 7 p.

    Research output: Contribution to journalArticlepeer-review

  4. Comparison of bonding in amorphous silicon and carbon

    Clark, S. J., Crain, J. & Ackland, G. J., 1 Jun 1997, In: Physical Review B: Condensed Matter and Materials Physics. 55, 21, p. 14059-14062 4 p.

    Research output: Contribution to journalArticlepeer-review

  5. Ab initio calculations of the self-interstitial in silicon

    Clark, S. J. & Ackland, G. J., 1 Jul 1997, In: Physical Review B: Condensed Matter and Materials Physics. 56, 1, 4 p., 47.

    Research output: Contribution to journalArticlepeer-review

  6. Ab initio studies of high-pressure structural transformations in silica (vol 55, pg 3465, 1997)

    Karki, BB., Warren, MC., Stixrude, L., Ackland, GJ. & Crain, J., 1 Aug 1997, In: Physical Review B: Condensed Matter and Materials Physics. 56, 5, p. 2884-2884 1 p.

    Research output: Contribution to journalArticlepeer-review

  7. Practical methods in ab initio lattice dynamics

    Ackland, GJ., Warren, MC. & Clark, SJ., 15 Sep 1997, In: Journal of Physics: Condensed Matter. 9, 37, p. 7861-7872 12 p.

    Research output: Contribution to journalArticlepeer-review

  8. Free energy of crystalline solids: A lattice-switch Monte Carlo method

    Bruce, A. D., Wilding, N. B. & Ackland, G. J., 20 Oct 1997, In: Physical Review Letters. 79, 16, p. 3002-3005 4 p.

    Research output: Contribution to journalArticlepeer-review

  9. 1998
  10. Ab initio molecular polarisabilities of liquid crystals: Application to DOBAMBC and 5CB

    Clark, S. J., Ackland, G. J. & Crain, J., 1998, In: Europhysics Letters. 44, 5, p. 578-584 7 p.

    Research output: Contribution to journalArticlepeer-review

  11. Dynamic overshoot in α-iron by atomistic simulations

    Machová, A. & Ackland, G. J., 1998, In: Modelling and simulation in materials science and engineering. 6, 5, p. 521-542 22 p.

    Research output: Contribution to journalArticlepeer-review

  12. Electronic structure calculations of liquid crystal molecules: Application to chiral solutes.

    Clark, SJ., Ackland, GJ. & Crain, J., 1998, LIQUID CRYSTALS: PHYSICS, TECHNOLOGY AND APPLICATIONS. Rutkowska, J., Klosowicz, SJ., Zielinski, J. & Zmija, J. (eds.). BELLINGHAM: SPIE-INT SOC OPTICAL ENGINEERING, p. 166-170 5 p. (PROCEEDINGS OF THE SOCIETY OF PHOTO-OPTICAL INSTRUMENTATION ENGINEERS (SPIE); vol. 3318).

    Research output: Chapter in Book/Report/Conference proceedingConference contribution

Previous 1...3 4 5 6 7 8 9 10 ...26 Next