Skip to content

libXC functional bug #27

@joegair

Description

@joegair

As requested, here is the bug report.
method 'LibXC(DSD-PBEB95-D3)' may not be available in orca if this is incorrect, please submit a bug report at https://github.com/QChASM/AaronTools.py/issues possible misspelling of: DSD-PBEB95 revDSD-PBEP2021-D4 DSD-PBEP86 LC-PBE revDOD-PBEP86-D4

DSD-PBEB95-D3 is included in orca6 when called via ! LibXC(functional)
https://www.faccts.de/docs/orca/6.0/manual/contents/detailed/model.html#simple-input-of-libxc-functionals

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