Tailored elastic behavior of multilayers through controlled interface structure D. WolfJ. A. Jaszczak Perspective Pages: 111 - 148
A comparison of methods for the computer modelling of crystal structures Peter J. CraggMichael G. B. Drew Research Papers Pages: 149 - 168
Determination of the mechanism of activation of the Ni-zeolite-Y catalyst by computational techniques A. R. GeorgeJ. S. SandersonC. R. A. Catlow Research Papers Pages: 169 - 176
The ab initio prediction of yet unknown molecular crystal structures by solving the crystal packing problem Heinrich R. KarfunkelFrank J. J. LeusenRobert J. Gdanitz Research Papers Pages: 177 - 185
The effect of surface relaxation and atomic vibration on the equilibrium shape of gold and copper crystallites R. NajafabadiD. J. Srolovitz Research Papers Pages: 187 - 197
Density functional methods as computational tools in materials design Y. S. LiM. A. van DaelenM. P. Teter Research Papers Pages: 199 - 214