References

  1. L. Versluis and T. Ziegler, The determination of Molecular Structure by Density Functional Theory, Journal of Chemical Physics 88, 322 (1988)
  1. L. Versluis, The determination of molecular structures by the HFS method, PhD thesis, University of Calgary, 1989
  1. L. Fan and T. Ziegler, Optimization of molecular structures by self consistent and non-local density functional theory, Journal of Chemical Physics 95, 7401 (1991)
  1. M. Swart and F.M. Bickelhaupt, Optimization of strong and weak coordinates, International Journal of Quantum Chemistry 106, 2536 (2006)
  1. E. Bitzek, P. Koskinen, F. Gähler, M. Moseler and P. Gumbsch, Structural Relaxation Made Simple, Physical Review Letters 97, 170201 (2006)

External programs and libraries

Click here for the list of programs and/or libraries used in the Amsterdam Modeling Suite. On some platforms optimized libraries have been used and/or vendor specific MPI implementations.