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aiida-hubbard

AiiDA plugin for the first-principles calculation of Hubbard parameters.

status stable AiiDA >=2.3,<2.6 || >2.6,<3.0

General information

Install pip install aiida-hubbard
Source code https://github.com/aiidateam/aiida-hubbard
Documentation No documentation provided by the package author.
Contact Lorenzo Bastonero <lbastone@uni-bremen.de>"Sebastiaan P. Huber" <mail@sphuber.net>
Python import import aiida_hubbard
Latest version 0.5.0
Released 2025-12-19

Registry checks

W009: Prefix 'quantumespresso.hp' does not follow naming convention.
Click any code (W001, E001…) to jump to troubleshooting instructions .

Plugins provided

Calculations 1 Parsers 1 Workflows 5 Console scripts 1

Entry points

CalcJobs and calculation functions aiida.calculations

  • quantumespresso.hp

    aiida_hubbard.calculations.hp:HpCalculation
CalcJob parsers aiida.parsers

  • quantumespresso.hp

    aiida_hubbard.parsers.hp:HpParser
WorkChains and work functions aiida.workflows

  • quantumespresso.hp.base

    aiida_hubbard.workflows.hp.base:HpBaseWorkChain

  • quantumespresso.hp.hubbard

    aiida_hubbard.workflows.hubbard:SelfConsistentHubbardWorkChain

  • quantumespresso.hp.main

    aiida_hubbard.workflows.hp.main:HpWorkChain

  • quantumespresso.hp.parallelize_atoms

    aiida_hubbard.workflows.hp.parallelize_atoms:HpParallelizeAtomsWorkChain

  • quantumespresso.hp.parallelize_qpoints

    aiida_hubbard.workflows.hp.parallelize_qpoints:HpParallelizeQpointsWorkChain
Console scripts console_scripts

  • aiida-hubbard

    aiida_hubbard.cli:cmd_root