mdsuite.calculators.nernst_einstein_ionic_conductivity module

MDSuite: A Zincwarecode package.

License

This program and the accompanying materials are made available under the terms of the Eclipse Public License v2.0 which accompanies this distribution, and is available at https://www.eclipse.org/legal/epl-v20.html

SPDX-License-Identifier: EPL-2.0

Copyright Contributors to the Zincwarecode Project.

Contact Information

email: zincwarecode@gmail.com github: https://github.com/zincware web: https://zincwarecode.com/

Citation

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Summary

class mdsuite.calculators.nernst_einstein_ionic_conductivity.NernstEinsteinIonicConductivity(**kwargs)[source]

Bases: Calculator

Class for the calculation of the Nernst-Einstein ionic conductivity.

Examples

experiment.run_computation.NernstEinsteinIonicConductivity()

run_post_generation_analysis()[source]

Run the analysis.

property truth_table

Builds a truth table to communicate which tensor_values is available to the analysis.

Returns:

truth_table – A truth table communication which tensor_values is available for the analysis.

Return type:

list