P U B L I C A T I O N S

The following paper is the "official" DISCUS paper. All publications containing results obtained using DISCUS should contain a reference to the following paper. Please send us an email with the reference of your paper containing DISCUS results, so that we can keep this list up to date.

  • PROFFEN, TH. & NEDER, R.B.
    DISCUS, a Program for Diffuse Scattering and Defect Structure Simulations (1997).
    J. Appl. Cryst., 30, 171-175

These are the original publications of DISCUS. These papers are short abstracts presented at conferences. The first paper introduced the concept of computer based structure simulations.

  • NEDER, R. & WILDGRUBER, U.
    DISCUS, ein interaktives Programm zur Simulation von Defektstrukturen und diffuser Streuung (1989).
    Z. Kristallogr., 186, 209

  • NEDER, R.B.
    DISCUS, ein Programmpaket zur Simulation von Defektstrukturen und diffuser Streuung (1993).
    Z. Kristallogr., Suppl. 7, 142

  • NEDER, R.B.
    DISCUS, a program to simulate defect structures and diffuse scattering (1994).
    Z. Kristallogr., Suppl. 8, 744

Here is a list of publications containing results which were completely or in part obtained using the program DISCUS.

  • PROFFEN, TH. & WELBERRY, T.R.
    Analysis of Diffuse Scattering of Single Crystals using Monte Carlo Methods (1998).
    Phase Trans., 67, 373-397

  • WELBERRY, T.R. & PROFFEN, TH.
    Analysis of Diffuse Scattering from Single Crystals via Reverse Monte Carlo Technique: I. Comparison with Direct Monte Carlo (1998).
    J. Appl. Cryst., 31, 309-317

  • PROFFEN, TH. & WELBERRY, T.R.
    Analysis of Diffuse Scattering from Single Crystals via Reverse Monte Carlo Technique: II. The Defect Structure of Calcium Stabilised Zirconias (1998).
    J. Appl. Cryst., 31, 318-326

  • PROFFEN, TH.
    Analysis of the diffuse neutron and X-ray scattering of stabilised zirconia using the Reverse-Monte-Carlo method (1997).
    Physica B, 241, 281-288

  • PROFFEN, TH. & WELBERRY, T.R.
    An Improved Method for Analysing Single Crystal Diffuse Scattering using the Reverse Monte Carlo Technique (1997).
    Z. Kristallogr., 212, 764-768

  • FREY, F.
    Diffuse scattering from periodic and aperiodic crystals. (1997)
    Z. Kristallogr., 212, 257-282

  • NEDER, R.B. & PROFFEN, TH.
    Teaching diffraction with the aid of computer simulations (1996).
    J. Appl. Cryst., 29, 727-735

  • PROFFEN, TH. & WELBERRY, T.R.
    Analysis of Diffuse Scattering via Reverse Monte Carlo Technique: a Systematic Investigation (1997).
    Acta Cryst. A53, 202-216

  • NEDER, R.B., HALBHUBER, A. & FREY, F.
    Direct determination of defect structures (1996).
    Z. Kristallogr., 211, 669-673

  • FREY, F., HRADIL, K. & NEDER, R.B.
    Superorder and disorder in decagonal phases Al-Co-Ni and Al-Co-Cu-(Si) phases (1996).
    in: Extended Abstracts of the Workshop on Aperiodic Structures,
    Krakow, Poland, 38-41

  • HRADIL, K., WEIDNER, E., NEDER, R.B., GRUSHKO, B. &
    FREY, F.
    Disorder in decagonal Al-Ni-Co investigated by X-ray diffraction and molecular simulations (1996).
    in: Extended Abstracts of the Workshop on Aperiodic Structures,
    Krakow, Poland, 136-139

  • WEBER, TH., BOYSEN, H., HONAL, M., FREY, F. &
    NEDER, R.B.
    Diffuse and satellite scattering in urea inclusion compounds with various alkane molecules (1996).
    Z. Kristallogr., 211, 238-246

  • NEDER, R.B.
    Influence of surface relaxations on X-ray intensities of microcrystals (1995).
    Z. Kristallogr., 210, 415-417

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