Ansible Role — AiiDA
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Updated
Jul 28, 2018
Ansible Role — AiiDA
AiiDA workchains for (water) adsorption isotherms
python interface to manage data requests from an external program, and calling aiida's functionalities
Collection of AiiDA WorkChains for Material Discovery Studies
Materials Simulation Environment
AiiDA plugin for the OpenMX DFT code
A plugin package that enables the usage of the FEniCS computing platform with the AiiDA framework.
A useful toolbox for using Aiida and constructing and viewing your initial structure for the simulation.
Interface with AiiDA to automate CASTEP calculations and preserve their provenance.
AiiDA plugin for Dummy engine in Yascheduler
AiiDA plugin for the spirit code
AiiDA data plugin for pandas DataFrame objects
This repository contains different tutorials for various juDFT codes
AiiDA plugin of the high-performance density functional theory code JuKKR (www.judft.de) for high-throughput electronic structure calculations.
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