Skip to content

Implement Packmol as an option for random initialization #186

@clpetix

Description

@clpetix

The current lattice packing method used by InitializeRandomly has some difficulty at higher packing fractions when there is more than one type with large differences in diameter. We should consider adding Packmol support in the future to cover these cases.

Metadata

Metadata

Assignees

No one assigned

    Labels

    No labels
    No labels

    Type

    No type

    Projects

    No projects

    Milestone

    No milestone

    Relationships

    None yet

    Development

    No branches or pull requests

    Issue actions