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aiida-spex

AiiDA plugin for SPEX code

status planning AiiDA >=1.0.0b3,<3.0.0

General information

Install pip install git+https://github.com/JuDFTteam/aiida-spex
Source code https://github.com/JuDFTteam/aiida-spex
Documentation No documentation provided by the package author.
Author(s) The SPEX Team
Contact a.chandran@fz-juelich.de
Python import import aiida_spex
Latest version 1.1.2

Registry checks

All checks passed

Plugins provided

Calculations 1 Parsers 1 Data 1 Workflows 1

Entry points

CalcJobs and calculation functions aiida.calculations

  • spex.spex

    aiida_spex.calculations.spex:SpexCalculation
Data node types aiida.data

  • spex.spexinp

    aiida_spex.data.spexinp:SpexinpData
CalcJob parsers aiida.parsers

  • spex.spexparser

    aiida_spex.parsers.spex:SpexParser
WorkChains and work functions aiida.workflows

  • spex.job

    aiida_spex.workflows.job:SpexJobWorkchain