Skip to content

How to convert a second-order force constant matrix obtained by almode to FORCE_CONSTANTS in phonopy format #186

Closed
Closed
How to convert a second-order force constant matrix obtained by almode to FORCE_CONSTANTS in phonopy format#186

Description

@YuwenCompPhys
YuwenCompPhys
opened on Apr 8, 2024

Now that I have the si.fcs and si.xml files, how do I convert them to FORCE_CONSTANTS

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