Periodic Building Unit (PerBU): | CAS layer | |||||
Layer symmetry | P 1 2/m (1) | |||||
2D cell parameters | a = 14.13 Å | b = 5.26 Å | gamma = 90° | |||
Examples |
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* relative to the previous layer |
Effect on channel system | |
The disorder does not block the channel system |
Polymorph CAS | |||||
Cell Parameters: | orthorhombic | C m c m: (# 63) | |||
a = 5.2560 Å | b = 14.1320 Å | c = 17.2270 Å | |||
α = 90.000° | β = 90.000° | γ = 90.000° | |||
Volume = | 1279.6 Å3 | ||||
Framework Density (FDSi): | 18.8 |
Ring sizes (# T-atoms): | 8 6 5 | ||
Channel dimensionality: | Topological (pore opening > 6-ring): 1-dimensional |
Maximum diameter of a sphere: | |||||||
that can be included | 5.05 Å | ||||||
that can diffuse along | a: 2.97 Å | b: 2.21 Å | c: 2.45 Å | ||||
addional volume data |
Composite Building Units: |
cas | bik | |||
In this space group and setting, the PerBUs are stacked along [001] Adjacent layers generated by the same connectivity pattern (same basic color) are shown with different shades for clarity. |
Note: This polymorph corresponds to the ordered framework CAS | |
Polymorph NSI | |||||
Cell Parameters: | monoclinic | C 1 2/m 1: (# 12) | |||
a = 14.1287 Å | b = 5.2535 Å | c = 8.9277 Å | |||
α = 90.000° | β = 105.370° | γ = 90.000° | |||
Volume = | 639.0 Å3 | ||||
Framework Density (FDSi): | 18.8 |
Ring sizes (# T-atoms): | 8 6 5 | ||
Channel dimensionality: | Topological (pore opening > 6-ring): 1-dimensional |
Maximum diameter of a sphere: | |||||||
that can be included | 4.16 Å | ||||||
that can diffuse along | a: 2.6 Å | b: 3.3 Å | c: 2.45 Å | ||||
addional volume data |
Composite Building Units: |
cas | bik | |||
In this space group and setting, the PerBUs are stacked along [001] Adjacent layers generated by the same connectivity pattern (same basic color) are shown with different shades for clarity. |
Note: This polymorph corresponds to the ordered framework NSI | |
Simple example of a random stacking of CAS and NSI polymorphs. | |
There is no blocking of the 1D channel system. |