tblite_reference_cli Module Reference

Optional native tblite command-line diagnostics. More...

Functions/Subroutines
subroutine, public	tb_reference_cli_compare (qs_env)
	Run native tblite CLI and compare against CP2K/tblite.

Detailed Description

Optional native tblite command-line diagnostics.

Note

This module has no dependency on the tblite library.

Function/Subroutine Documentation

tb_reference_cli_compare()

subroutine, public tblite_reference_cli::tb_reference_cli_compare

(

type(qs_environment_type), pointer

qs_env

)

Run native tblite CLI and compare against CP2K/tblite.

Parameters

qs_env

...

Definition at line 70 of file tblite_reference_cli.F.

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