MDS: Materials of different compositions
Metal Decorated Silsesquioxane Matrix 0% Titanium and Low Density
This image shows an atomistic model (spacefilling) of the structure in a Metal Decorated Silsesquioxane (MD-Si8O12) matrix with 0% titanium and at low density.
The cubic simulation cell has a side length of 50 Å and contains a periodic structure.
Metal Decorated Silsesquioxane 50% Titanium Low Density
This image shows an atomistic model (spacefilling) of the structure in a Metal Decorated Silsesquioxane (MD-Si8O12) matrix with 50% titanium and at low density. The cubic simulation cell has a side length of 50 Å and contains a periodic structure.
Metal Decorated Silsesquioxane Matrix 100% Titanium and Low Density
This image shows an atomistic model (spacefilling) of the structure in a Metal Decorated Silsesquioxane (MD-Si8O12) matrix with 100% titanium and at low density. The cubic simulation cell has a side length of 50 Å and contains a periodic structure.
Metal Decorated Silsesquioxane 0% Titanium High Density
This image shows an atomistic model (spacefilling) of the structure in a Metal Decorated Silsesquioxane (MD-Si8O12) matrix with 0% titanium and at high density. The cubic simulation cell has a side length of 50 Å and contains a periodic structure.
Metal Decorated Silsesquioxane 50% Titanium High Density
This image shows an atomistic model (spacefilling) of the structure in a Metal Decorated Silsesquioxane (MD-Si8O12) matrix with 50% titanium and at high density. The cubic simulation cell has a side length of 50 Å and contains a periodic structure.
Metal Decorated Silsesquioxane 100% Titanium High Density
This image shows an atomistic model (spacefilling) of the structure in a Metal Decorated Silsesquioxane (MD-Si8O12) matrix with 100% titanium and at high density. The cubic simulation cell has a side length of 50 Å and contains a periodic structure.
Color Legend:
- beige = silicon
- blue = adsorbed H2
- dark gray = carbon
- green = chlorine
- light gray = titanium
- maroon = absorbed CH4
- red = oxygen
- white = hydrogen
posted: May 2014.
updated: May 2014.