Expand description
Framework assembly: connecting SBUs into periodic crystal structures.
The assembly process:
- Define metal-node SBUs and organic-linker SBUs
- Specify a target topology (e.g., cubic pcu for MOF-5)
- Place nodes at predefined positions within the unit cell
- Connect them via linkers along edges of the topology net
- Output the assembled periodic structure
Structs§
- Crystal
Atom - A placed atom in the assembled crystal structure.
- Crystal
Structure - An assembled periodic crystal structure.
- Topology
- Topology definition: positions and edges for a network.
Functions§
- assemble_
framework - Assemble a framework by placing SBUs on a topology.